N-[2-(1H-imidazol-4-yl)ethyl]-4-[({3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]benzamide
Chemical Structure Depiction of
N-[2-(1H-imidazol-4-yl)ethyl]-4-[({3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]benzamide
N-[2-(1H-imidazol-4-yl)ethyl]-4-[({3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]benzamide
Compound characteristics
| Compound ID: | C797-1546 |
| Compound Name: | N-[2-(1H-imidazol-4-yl)ethyl]-4-[({3-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}sulfanyl)methyl]benzamide |
| Molecular Weight: | 498.61 |
| Molecular Formula: | C27 H26 N6 O2 S |
| Smiles: | COc1ccc(Cn2c(nc3cccnc23)SCc2ccc(cc2)C(NCCc2c[nH]cn2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2518 |
| logD: | 3.2474 |
| logSw: | -3.4293 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.976 |
| InChI Key: | ORFHLEDSUGTUIU-UHFFFAOYSA-N |