2-bromo-10H-indolo[3,2-b]quinoline-11-carboxamide
PubChem CID: 10640851
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| Compound Synonyms | CHEMBL490114, SCHEMBL3291598 |
|---|---|
| Topological Polar Surface Area | 71.8 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 21.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 432.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2-bromo-10H-indolo[3,2-b]quinoline-11-carboxamide |
| Prediction Hob | 1.0 |
| Xlogp | 3.3 |
| Molecular Formula | C16H10BrN3O |
| Prediction Swissadme | 0.0 |
| Inchi Key | WJMOLTXLGFWETF-UHFFFAOYSA-N |
| Fcsp3 | 0.0 |
| Logs | -5.976 |
| Rotatable Bond Count | 1.0 |
| Logd | 3.161 |
| Compound Name | 2-bromo-10H-indolo[3,2-b]quinoline-11-carboxamide |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 339.001 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 339.001 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 340.17 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -5.033663619047618 |
| Inchi | InChI=1S/C16H10BrN3O/c17-8-5-6-12-10(7-8)13(16(18)21)15-14(19-12)9-3-1-2-4-11(9)20-15/h1-7,20H,(H2,18,21) |
| Smiles | C1=CC=C2C(=C1)C3=NC4=C(C=C(C=C4)Br)C(=C3N2)C(=O)N |
| 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