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Efavirenz

PubChem CID: 64139

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Compound Synonyms efavirenz, 154598-52-4, Sustiva, Stocrin, DMP-266, (-)-Efavirenz, DMP 266, (S)-Efavirenz, (4S)-6-Chloro-4-(cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one, Viraday, Efavirenz teva, EFV, (4S)-6-chloro-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one, (4S)-6-Chloro-4-(2-cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one, Sustiva (TN), L-743726, Efavirenzum, L-743,726, HSDB 7163, Efavirenz [USP:INN:BAN], Efavirenz, (S), NSC-742403, DMP266, JE6H2O27P8, (S)-6-Chloro-4-(cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one, DTXSID9046029, CHEBI:119486, EFAVIRENZ [INN], EFAVIRENZ [JAN], EFAVIRENZ [MI], EFAVIRENZ [HSDB], EFAVIRENZ [USAN], (-)-6-CHLORO-4-CYCLOPROPYLETHYNYL-4-TRIFLUOROMETHYL-1,4-DIHYDRO-2H-3,1-BENZOXAZIN-2-ONE, (4S)-6-chloro-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-2,4-dihydro-1H-3,1-benzoxazin-2-one, EFAVIRENZ [VANDF], MFCD05662344, EFAVIRENZ [MART.], EFAVIRENZ [USP-RS], EFAVIRENZ [WHO-DD], EFAVIRENZ [WHO-IP], EFAVIRENZ [EMA EPAR], EFAVIRENZ [ORANGE BOOK], DTXCID7026029, TELURA COMPONENT EFAVIRENZ, EFAVIRENZ [USP MONOGRAPH], (Rac)-Efavirenz, ATRIPLA COMPONENT EFAVIRENZ, EFAVIRENZUM [WHO-IP LATIN], NSC742403, (4S)-6-chloro-4-(cyclopropylethynyl)-4-(trifluoromethyl)-1,4-dihydro-2H-3,1-benzoxazin-2-one, (S)-6-Chloro-4-cyclopropylethynyl-4-trifluoromethyl-1,4-dihydro-benzo[d][1,3]oxazin-2-one, NSC 742403, (S)-6-CHLORO-4-(CYCLOPROPYLETHYNYL)-4-(TRIFLUOROMETHYL)-1H-BENZO[D][1,3]OXAZIN-2(4H)-ONE, 2H-3,1-Benzoxazin-2-one, 6-chloro-4-(cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-, (4S)-, 6-chloro-4-(2-cyclopropyl-1-ethynyl)-4-trifluoromethyl-(4S)-1,4-dihydro-2H-benzo[d][1,3]oxazin-2-one, efavirenz, (S)-isomer, EFAVIRENZ (MART.), EFAVIRENZ (USP-RS), (s)-6-chloro-4-cyclopropylethynyl-4-trifluoromethyl-1,4-dihydro-2H-3,1-benzoxazin-2-one, Efavirenz (USP:INN:BAN), ent Efavirenz, (Rac)-DMP 266, (Rac)-EFV, (Rac)-L-743726, EFAVIRENZ (USP MONOGRAPH), Eravirenz, (S)-6-chloro-4-(Cyclopropylethynyl)-1,4-dihydro-(S)-6-chloro-4-(cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one, 2H-3,1-Benzoxazin-2-one, 6-chloro-4-(2-cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-, (4S)-, SMR000466351, Strocin (TM), Sustiva (TM), CAS-154598-52-4, L 743726, SR-01000759360, L-741211, L-743725, UNII-JE6H2O27P8, Met-SDF-1.beta. & Efavirenz, 1ikv, 1ikw, (S)-6-chloro-4-cyclopropylethynyl-4-trifluoromethyl-1,4-dihydro-benzo(d)(1,3)oxazin-2-one, NCGC00159337-02, 6-chloro-4-(2-cyclopropyl-1-ethynyl)-4-trifluoromethyl-(4S)-1,4-dihydro-2H-benzo(d)(1,3)oxazin-2-one, Efavirenz & PLGA, Sustiva 600, Efavirenz (Standard), Efavirenz & IFNL1, Efavirenz & IFNL2, Efavirenz & IFNL3, Efavirenz & IL-29, DMP-266, Efavirenz, Efavirenz & IL-28A, Efavirenz & IL-28B, EFV & Interleukin 29, EFV & Interleukin 28A, EFV & Interleukin 28B, EFV & PLGA, EFV & IFNL1, EFV & IFNL2, EFV & IFNL3, Efavirenz (JAN/USP/INN), EFV & Interferon lambda-1, EFV & Interferon lambda-2, EFV & Interferon lambda-3, Efavirenz & Interleukin 29, SCHEMBL37762, Efavirenz & Interleukin 28A, Efavirenz & Interleukin 28B, MLS000759465, MLS001424087, BIDD:GT0383, Efavirenz - Bio-X trade mark, BDBM2483, CHEMBL223228, EFV & IL-28A, EFV & IL-28B, L 743,726, Efavirenz, >=98% (HPLC), Efavirenz & Interferon lambda-1, Efavirenz & Interferon lambda-2, Efavirenz & Interferon lambda-3, EFV & IL-29, GTPL11287, J05AG03, BCPP000245, GLXC-04867, HMS2051J08, HMS2090N16, HMS3393J08, HMS3713M14, Met-Stromal Cell-derived Factor-1.beta. (Human) & Efavirenz, BCP27719, Tox21_111582, DL-535, HY-10572R, s4685, EFAVIRENZ COMPONENT OF ATRIPLA, AKOS015894951, Tox21_111582_1, AB21723, BCP9000636, CCG-101011, DB00625, EFAVIRENZ 200MG SCORED TABLETS, FC30275, KS-5380, MK-0831, NC00261, Efavirenz 100 microg/mL in Acetonitrile, NCGC00159337-04, NCGC00159337-12, NCGC00271713-05, NCGC00271713-08, AC-25006, BC164402, HY-10572, E0997, NS00000604, C08088, D00896, EN300-219935, F17329, AB00639956-06, AB00639956-08, A809555, L743726, Q422645, SR-01000759360-4, SR-01000759360-5, BRD-K40758068-001-08-2, Z2177953192, Efavirenz, United States Pharmacopeia (USP) Reference Standard, (4S)-6-chloranyl-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one, 2H-3, 6-chloro-4-(cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-, (4S)-, (S)-6-Chloro-4-(cyclopropyl-ethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazine-2-one, (S)-6-chloro-4-(cyclopropylethynyl)-4-(trifluoromethyl)-1,4-dihydro-2H-3,1-ben zoxazin-2-one, (S)-6-chloro-4-(cyclopropylethynyl)-4-(trifluoromethyl)-1,4-dihydro-2H-3,1-benzoxazin-2-one, 620-492-6
Topological Polar Surface Area 38.3
Hydrogen Bond Donor Count 1.0
Heavy Atom Count 21.0
Isotope Atom Count 0.0
Molecular Complexity 519.0
Database Name cmaup_ingredients;pubchem
Defined Atom Stereocenter Count 1.0
Iupac Name (4S)-6-chloro-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one
Prediction Hob 1.0
Xlogp 4.0
Molecular Formula C14H9ClF3NO2
Prediction Swissadme 1.0
Inchi Key XPOQHMRABVBWPR-ZDUSSCGKSA-N
Fcsp3 0.3571428571428571
Logs -6.399
Rotatable Bond Count 1.0
Logd 3.562
Compound Name Efavirenz
Prediction Hob Swissadme 1.0
Exact Mass 315.027
Formal Charge 0.0
Monoisotopic Mass 315.027
Hydrogen Bond Acceptor Count 5.0
Molecular Weight 315.67
Covalent Unit Count 1.0
Total Atom Stereocenter Count 1.0
Total Bond Stereocenter Count 0.0
Esol -4.676832171428571
Inchi InChI=1S/C14H9ClF3NO2/c15-9-3-4-11-10(7-9)13(14(16,17)18,21-12(20)19-11)6-5-8-1-2-8/h3-4,7-8H,1-2H2,(H,19,20)/t13-/m0/s1
Smiles C1CC1C#C[C@]2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F
Nring 3.0
Defined Bond Stereocenter Count 0.0

  • 1. Outgoing r'ship FOUND_IN to/from Isatis Tinctoria (Plant) Rel Props:Source_db:cmaup_ingredients
  • 2. Outgoing r'ship FOUND_IN to/from Salvia Miltiorrhiza (Plant) Rel Props:Source_db:cmaup_ingredients
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