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Indomethacin

PubChem CID: 3715

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Compound Synonyms indomethacin, 53-86-1, indometacin, Indocin, Indomethacine, Indometacine, Indocid, Reumacide, Indomethazine, Metindol, Artrinovo, Confortid, Idomethine, Indomecol, Indomethacinum, Metartril, Methazine, Artrivia, Dolovin, Imbrilon, Indacin, Indomed, Indomee, Indoptol, Infrocin, Metacen, Sadoreum, Amuno, Inacid, Tannex, Indo-rectolmin, Inteban sp, Artracin, Durametacin, Indoptic, Inflazon, Mikametan, Lausit, Mezolin, Mobilan, Indo-tablinen, Indo-Lemmon, Indometacinum, Indometacina, Indometacyna, Indometicina, Indocin Sr, Aconip, 2-(1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl)acetic acid, 1H-Indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-, Indmethacine, Dolcidium, Elmetacin, Indomethine, Indorektal, Tivorbex, Catlep, Indoxen, Vonum, Indo-phlogont, Chibro-amuno, Bonidon Gel, Dolcidium PL, Rheumacin LA, Osmosin, 1-(p-Chlorobenzoyl)-5-methoxy-2-methylindole-3-acetic acid, CCRIS 3502, HSDB 3101, Indometacine [INN-French], Indometacinum [INN-Latin], Indometacina [INN-Spanish], FLAM, MFCD00057095, Inteban, 1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetic acid, 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid, 1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-3-indoleacetic acid, NCI-C56144, UNII-XXE1CET956, EINECS 200-186-5, XXE1CET956, Indometacin [INN], NSC-757061, 1-(p-Chlorobenzoyl)-2-methyl-5-methoxyindole-3-acetic acid, BRN 0497341, USAN, Indomethacin (Indocid, Indocin), CHEBI:49662, CHEMBL6, NSC-77541, IMN, Indole-3-acetic acid, 1-(p-chlorobenzoyl)-5-methoxy-2-methyl-, Indomethacin [USAN:USP], alpha-(1-(p-Chlorobenzoyl)-2-methyl-5-methoxy-3-indolyl)acetic acid, 2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl-1h-indol-3-yl}acetic acid, N-p-Chlorbenzoyl-5-methoxy-2-methylindole-3-acetic acid, MLS000069402, DTXSID9020740, (1-p-Chlorobenzoyl-5-methoxy-2-methylindol-3-yl)acetic acid, 1-(p-chlorobenzoyl)-5-methoxy-2-methyl-3-indolylacetic acid, 1-(p-Chlorobenzoyl)-2-methoxy-3-methyl-1H-indole-3-acetic Acid, Indomet 140, EC 200-186-5, [1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetic acid, 5-22-05-00239 (Beilstein Handbook Reference), {1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl-1H-indol-3-yl}acetic acid, NSC 757061, CAS-53-86-1, 1-p-Cloro-benzoil-5-metoxi-2-metilindol-3-acido acetico, NCGC00015562-18, Indomethancin, 1-(4-chlorobenzoyl)-5-methoxy-2-methylindole-3-acetic acid, Arthrexin, Bonidin, Bonidon, Indameth, Indomod, Miametan, SMR000058195, Indomo, Flexin continus, Hicin, Kwas 1-(p-chlorobenzoilo)-2-metylo-5-metoksy-3-indolilooctowy, Chrono-indicid, Chrono-indocid, Indometacyna [Polish], Indometicina [Spanish], 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetic acid, Indo-Spray, Indomethacin (USAN:USP), Indolar SR, Indometacine (INN-French), Indometacinum (INN-Latin), Indometacina (INN-Spanish), INDOMETACIN (MART.), INDOMETACIN [MART.], DTXCID50740, INDOMETHACIN (USP-RS), INDOMETHACIN [USP-RS], 1-(p-chlorobenzoyl)-2-methyl-5-methoxy-3-indoleacetic acid, INDOMETACIN (EP MONOGRAPH), INDOMETACIN [EP MONOGRAPH], INDOMETHACIN (USP MONOGRAPH), INDOMETHACIN [USP MONOGRAPH], 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]acetic acid, (1-(4-CHLOROBENZOYL)-5-METHOXY-2-METHYL-1H-INDOL-3-YL)ACETIC ACID, 2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methylindol-3-yl}acetic acid, Indocin-SR, Indochron E-R, Indocin (TN), ACEMETACIN IMPURITY B (EP IMPURITY), ACEMETACIN IMPURITY B [EP IMPURITY], Aconip (TN), Indomethacin (USP), NSC77541, Indocid (pharmaceutical), SR-01000000014, Indomethacin & MAP-30, Indocollyre, Indonol, Innamit, 1-(p-Chlorobenzoyl)-5-methoxy-2-methyl-Indole-3-acetic acid, IndomethacinER, Indomethacin ER, 2-{1-((4-chlorophenyl)carbonyl)-5-methoxy-2-methylindol-3-yl}acetic acid, 4kyk, (1-((4-chlorophenyl)carbonyl)-5-methoxy-2-methyl-1H-indol-3-yl)acetic acid, Indomethacin,(S), Prestwick_597, Indomethacin (GMP), INDREN, Indometacinum (Latin), Opera_ID_56, Spectrum_000919, Tocris-1708, 1z9h, Indomethacin (Standard), 1-(p-Chlorbenzoyl)-5-methoxy-2-methylindol-3-essigsaeure [German], 1-p-Cloro-benzoil-5-metoxi-2-metilindol-3-acido acetico [Spanish], Prestwick0_000272, Prestwick1_000272, Prestwick2_000272, Prestwick3_000272, Spectrum2_000970, Spectrum3_000468, Spectrum4_000018, Spectrum5_000868, INDOMETACIN [JAN], INDOMETHACIN [MI], Lopac-I-7378, Kwas 1-(p-chlorobenzoilo)-2-metylo-5-metoksy-3-indolilooctowy [Polish], Indometacin (Indomethacin), CHRONO-INDOCID 75, MolMap_000032, UPCMLD-DP023, I 7378, Indometacin (JP18/INN), INDOMETHACIN [HSDB], INDOMETHACIN [USAN], SCHEMBL9300, INDOMETHACIN [VANDF], Indomethacin Extended-release, Lopac0_000692, Oprea1_686105, BSPBio_000144, BSPBio_001149, BSPBio_002176, INDOMETACIN [WHO-DD], INDOMETACIN [WHO-IP], Indomethacine impurity mixture, KBioGR_000395, KBioGR_000489, KBioSS_000489, KBioSS_001399, MLS001074194, MLS006011845, BIDD:GT0132, DivK1c_000271, SPECTRUM1500350, SPBio_000979, SPBio_002363, BPBio1_000160, GTPL1909, Indomethacin, >=99% (TLC), UPCMLD-DP023:001, BDBM17638, CGIGDMFJXJATDK-UHFFFAOYSA-, HMS500N13, KBio1_000271, KBio2_000489, KBio2_001399, KBio2_003057, KBio2_003967, KBio2_005625, KBio2_006535, KBio3_000897, KBio3_000898, KBio3_001396, 1-(p-Chlorbenzoyl)-5-methoxy-2-methylindol-3-essigsaeure, C01EB03, M01AB01, M02AA23, S01BC01, Indomethacin - CAS 53-86-1, NINDS_000271, Bio2_000405, Bio2_000885, HMS1362I11, HMS1568H06, HMS1792I11, HMS1920F21, HMS1990I11, HMS2089N19, HMS2091N09, HMS2095H06, HMS2231J10, HMS3262K05, HMS3268A14, HMS3374F07, HMS3403I11, HMS3414N13, HMS3430L03, HMS3649K17, HMS3655O04, HMS3678N11, HMS3712H06, HMS3747K21, HMS3884E08, Indomethacin - Bio-X trade mark, INDOMETHACIN [ORANGE BOOK], Indomethacin-d4(chlorobenzoyl-d4), Pharmakon1600-01500350, BCP18951, MDA37708, Tox21_113109, Tox21_201791, Tox21_300266, Tox21_500692, AC-532, CCG-40186, HB4422, HY-14397G, HY-14397R, INDOMETACINUM [WHO-IP LATIN], NSC757061, s1723, STL257874, AKOS000592893, Tox21_113109_1, AT13679, DB00328, FI24585, Indometacin 1.0 mg/ml in Acetonitrile, KS-5255, LP00692, SDCCGSBI-0050670.P005, IDI1_000271, IDI1_002160, NCGC00015562-01, NCGC00015562-02, NCGC00015562-03, NCGC00015562-04, NCGC00015562-05, NCGC00015562-06, NCGC00015562-07, NCGC00015562-08, NCGC00015562-09, NCGC00015562-10, NCGC00015562-11, NCGC00015562-12, NCGC00015562-13, NCGC00015562-14, NCGC00015562-15, NCGC00015562-16, NCGC00015562-17, NCGC00015562-19, NCGC00015562-20, NCGC00015562-21, NCGC00015562-22, NCGC00015562-24, NCGC00015562-25, NCGC00015562-40, NCGC00024135-02, NCGC00024135-04, NCGC00024135-05, NCGC00024135-06, NCGC00024135-07, NCGC00024135-08, NCGC00024135-09, NCGC00024135-10, NCGC00024135-11, NCGC00024135-12, NCGC00024135-13, NCGC00024135-14, NCGC00024135-15, NCGC00254075-01, NCGC00259340-01, NCGC00261377-01, BI166166, BP-30207, HY-14397, NCI60_041708, O-Desmethyl-des-4-chlorobenzoylacemetacin, SBI-0050670.P004, DB-052413, AB00052022, EU-0100692, I0655, NS00000217, SW196768-5, EN300-16807, Indomethacin, meets USP testing specifications, BIM-0050670.0001, C01926, D00141, S00108, AB00052022-20, AB00052022-21, AB00052022_23, AB00052022_24, L000959, Q409231, SR-01000000014-2, SR-01000000014-4, SR-01000000014-6, 1-(4-Chlorobenzoyl)-5-methoxy-2-met hyl-1H-indole, BRD-K57222227-001-06-1, BRD-K57222227-001-18-6, BRD-K57222227-001-27-7, BRD-K57222227-001-28-5, BRD-K57222227-001-29-3, BRD-K57222227-001-30-1, SR-01000000014-10, SR-01000000014-16, Z56784896, 1-p-chlorobenzoyl-2-methyl-5-methoxyindol-3-acetic acid, 1-(p-chlorobenzoyl)-5-methoxy-2-methyl-3-indoleacetic acid, 1-(p-Chlorobenzoyl)-5-methoxy-2-methylindol-3-acetic acid, 1-(p-chlorobenzyl)-5-methoxy-2-methylindole-3-acetic acid, 1-(4-chloro-benzoyl)-5-methoxy-2-methyl-3-indolyl-acetic acid, 1-(4-Chlorobenzoyl)-2-methyl-5-methoxyindole-3-acetic acid, 1-(p-Chlorobenzoyl)-2-methyl-5-methoxy-3-indole-acetic acid, 1-(p-chlorobenzoyl)-2-methyl-5-methoxy-3-indolylacetic acid, 1-(p-chlorobenzoyl)-5-methoxy-2-methyl-3-indol acetic acid, Indomethacin, European Pharmacopoeia (EP) Reference Standard, N-(p-Chlorobenzoyl)-2-methyl-5-methoxy-3-indolylacetic acid, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1-H-indole-3-acetic acid, Indomethacin, United States Pharmacopeia (USP) Reference Standard, N-P-CHLOROBENZOYL-5-METHOXY-2-METHYLINDOLE-3-ACETIC ACID, .alpha.-(1-(p-Chlorobenzoyl)-2-methyl-5-methoxy-3-indolyl)acetic acid, [1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetic acid #, 1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetic acid & MAP-30, 1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetic acid, Indometacin, 1H-Indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl- (9CI), 2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2 methylindol-3-yl}acetic acid, 2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2methylindol-3-yl}acetic acid, Indole-3-acetic acid, 1-(p-chlorobenzoyl)-5-methoxy-2-methyl- (8CI), Indomethacin, Pharmaceutical Secondary Standard, Certified Reference Material, 200-186-5, InChI=1/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)
Topological Polar Surface Area 68.5
Hydrogen Bond Donor Count 1.0
Heavy Atom Count 25.0
Isotope Atom Count 0.0
Molecular Complexity 506.0
Database Name cmaup_ingredients;pubchem
Defined Atom Stereocenter Count 0.0
Iupac Name 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetic acid
Prediction Hob 1.0
Target Id NPT31, NPT30, NPT570, NPT41, NPT300, NPT604, NPT4734, NPT1594, NPT612, NPT99, NPT102, NPT1566, NPT98, NPT3504, NPT3506, NPT3505, NPT3507, NPT665, NPT669, NPT622, NPT72, NPT73, NPT668, NPT956, NPT153, NPT713, NPT1249, NPT1028, NPT5976
Xlogp 4.3
Molecular Formula C19H16ClNO4
Prediction Swissadme 0.0
Inchi Key CGIGDMFJXJATDK-UHFFFAOYSA-N
Fcsp3 0.1578947368421052
Logs -5.424
Rotatable Bond Count 4.0
Logd 2.863
Compound Name Indomethacin
Prediction Hob Swissadme 0.0
Exact Mass 357.077
Formal Charge 0.0
Monoisotopic Mass 357.077
Hydrogen Bond Acceptor Count 4.0
Molecular Weight 357.8
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 0.0
Esol -4.8624166
Inchi InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)
Smiles CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)O
Nring 3.0
Defined Bond Stereocenter Count 0.0

  • 1. Outgoing r'ship FOUND_IN to/from Alpinia Blepharocalyx (Plant) Rel Props:Source_db:cmaup_ingredients
  • 2. Outgoing r'ship FOUND_IN to/from Ceiba Pentandra (Plant) Rel Props:Source_db:cmaup_ingredients
  • 3. Outgoing r'ship FOUND_IN to/from Cleidion Brevipetiolatum (Plant) Rel Props:Source_db:cmaup_ingredients
  • 4. Outgoing r'ship FOUND_IN to/from Curcuma Kwangsiensis (Plant) Rel Props:Source_db:cmaup_ingredients
  • 5. Outgoing r'ship FOUND_IN to/from Dendrobium Crepidatum (Plant) Rel Props:Source_db:cmaup_ingredients
  • 6. Outgoing r'ship FOUND_IN to/from Euphorbia Fischeriana (Plant) Rel Props:Source_db:cmaup_ingredients
  • 7. Outgoing r'ship FOUND_IN to/from Humulus Lupulus (Plant) Rel Props:Source_db:cmaup_ingredients
  • 8. Outgoing r'ship FOUND_IN to/from Inula Japonica (Plant) Rel Props:Source_db:cmaup_ingredients
  • 9. Outgoing r'ship FOUND_IN to/from Perilla Frutescens (Plant) Rel Props:Source_db:cmaup_ingredients
  • 10. Outgoing r'ship FOUND_IN to/from Physalis Angulata (Plant) Rel Props:Source_db:cmaup_ingredients
  • 11. Outgoing r'ship FOUND_IN to/from Plantago Major (Plant) Rel Props:Source_db:cmaup_ingredients
  • 12. Outgoing r'ship FOUND_IN to/from Vernonia Colorata (Plant) Rel Props:Source_db:cmaup_ingredients
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