N-[2-(3,4-diethoxyphenyl)ethyl]-4-{[(3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]methyl}benzamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-4-{[(3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]methyl}benzamide
N-[2-(3,4-diethoxyphenyl)ethyl]-4-{[(3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]methyl}benzamide
Compound characteristics
| Compound ID: | C797-0050 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-4-{[(3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]methyl}benzamide |
| Molecular Weight: | 476.6 |
| Molecular Formula: | C26 H28 N4 O3 S |
| Smiles: | CCOc1ccc(CCNC(c2ccc(CSc3nc4ccncc4[nH]3)cc2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 2.6706 |
| logD: | 2.6103 |
| logSw: | -2.8438 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.173 |
| InChI Key: | ISKDBWXEYNRZNM-UHFFFAOYSA-N |