N-[3-(azepan-1-yl)propyl]-2-(2-methoxyethyl)-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-2-(2-methoxyethyl)-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
N-[3-(azepan-1-yl)propyl]-2-(2-methoxyethyl)-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide
Compound characteristics
| Compound ID: | C237-1165 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-2-(2-methoxyethyl)-9-methyl-1-oxo-2,9-dihydro-1H-pyrido[3,4-b]indole-4-carboxamide |
| Molecular Weight: | 438.57 |
| Molecular Formula: | C25 H34 N4 O3 |
| Smiles: | Cn1c2C(N(CCOC)C=C(C(NCCCN3CCCCCC3)=O)c2c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8517 |
| logD: | -0.719 |
| logSw: | -2.341 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.284 |
| InChI Key: | KIRHSHXCZRWHBF-UHFFFAOYSA-N |