2-(4-{[(4-methylphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)-1-[4-(pyridin-2-yl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-{[(4-methylphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)-1-[4-(pyridin-2-yl)piperazin-1-yl]ethan-1-one
2-(4-{[(4-methylphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)-1-[4-(pyridin-2-yl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | M056-0307 |
| Compound Name: | 2-(4-{[(4-methylphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)-1-[4-(pyridin-2-yl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 457.6 |
| Molecular Formula: | C26 H27 N5 O S |
| Smiles: | Cc1ccc(CSc2c3ccn(CC(N4CCN(CC4)c4ccccn4)=O)c3ccn2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.937 |
| logD: | 3.925 |
| logSw: | -3.7644 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.149 |
| InChI Key: | BQAOINQMCIKQGZ-UHFFFAOYSA-N |