N-[4-(cyanomethyl)phenyl]-3-{3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}propanamide
Chemical Structure Depiction of
N-[4-(cyanomethyl)phenyl]-3-{3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}propanamide
N-[4-(cyanomethyl)phenyl]-3-{3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}propanamide
Compound characteristics
| Compound ID: | C614-0920 |
| Compound Name: | N-[4-(cyanomethyl)phenyl]-3-{3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}propanamide |
| Molecular Weight: | 425.49 |
| Molecular Formula: | C25 H23 N5 O2 |
| Smiles: | COc1ccc(Cn2c(CCC(Nc3ccc(CC#N)cc3)=O)nc3cccnc23)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.0356 |
| logD: | 3.0354 |
| logSw: | -3.3855 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.963 |
| InChI Key: | DCCOTQBSMQHMLU-UHFFFAOYSA-N |