1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-(4-{[(4-methylphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)ethan-1-one
Chemical Structure Depiction of
1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-(4-{[(4-methylphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)ethan-1-one
1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-(4-{[(4-methylphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | M056-0330 |
| Compound Name: | 1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-(4-{[(4-methylphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)ethan-1-one |
| Molecular Weight: | 486.64 |
| Molecular Formula: | C28 H30 N4 O2 S |
| Smiles: | Cc1ccc(CSc2c3ccn(CC(N4CCN(CC4)c4ccc(cc4)OC)=O)c3ccn2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3733 |
| logD: | 4.3614 |
| logSw: | -4.177 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.182 |
| InChI Key: | LMCGDBUIZAXPTD-UHFFFAOYSA-N |