10-Acetylquindoline
PubChem CID: 928867
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| Compound Synonyms | 10-Acetylquindoline, 10-N-Acetylquindoline, Oprea1_706724, CHEMBL522105, SCHEMBL8482919, IYGDQWWAZFBUCM-UHFFFAOYSA-N, STK092807, AKOS030490553, 10-acetyl-10H-indolo[3,2-b]quinoline, 1-(10H-indolo[3,2-b]quinolin-10-yl)ethanone, AH-262/11508013 |
|---|---|
| Topological Polar Surface Area | 34.9 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 20.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 396.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1-indolo[3,2-b]quinolin-10-ylethanone |
| Prediction Hob | 1.0 |
| Xlogp | 3.2 |
| Molecular Formula | C17H12N2O |
| Prediction Swissadme | 0.0 |
| Inchi Key | IYGDQWWAZFBUCM-UHFFFAOYSA-N |
| Fcsp3 | 0.0588235294117647 |
| Logs | -5.739 |
| Rotatable Bond Count | 0.0 |
| Logd | 3.422 |
| Compound Name | 10-Acetylquindoline |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 260.095 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 260.095 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 260.29 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -4.272235199999999 |
| Inchi | InChI=1S/C17H12N2O/c1-11(20)19-15-9-5-3-7-13(15)17-16(19)10-12-6-2-4-8-14(12)18-17/h2-10H,1H3 |
| Smiles | CC(=O)N1C2=CC=CC=C2C3=NC4=CC=CC=C4C=C31 |
| Nring | 4.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Genipa Americana (Plant) Rel Props:Source_db:cmaup_ingredients