N-[2-(azepan-1-yl)ethyl]-4-{[2-(benzylsulfanyl)-3H-imidazo[4,5-b]pyridin-3-yl]methyl}benzamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-4-{[2-(benzylsulfanyl)-3H-imidazo[4,5-b]pyridin-3-yl]methyl}benzamide
N-[2-(azepan-1-yl)ethyl]-4-{[2-(benzylsulfanyl)-3H-imidazo[4,5-b]pyridin-3-yl]methyl}benzamide
Compound characteristics
| Compound ID: | C797-1576 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-4-{[2-(benzylsulfanyl)-3H-imidazo[4,5-b]pyridin-3-yl]methyl}benzamide |
| Molecular Weight: | 499.68 |
| Molecular Formula: | C29 H33 N5 O S |
| Smiles: | C1CCCN(CC1)CCNC(c1ccc(Cn2c(nc3cccnc23)SCc2ccccc2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7004 |
| logD: | 3.7237 |
| logSw: | -4.4329 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.952 |
| InChI Key: | HBCOWBPWZWNVCQ-UHFFFAOYSA-N |