2-(4-{[(4-methoxyphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)-1-(4-phenylpiperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-(4-{[(4-methoxyphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)-1-(4-phenylpiperazin-1-yl)ethan-1-one
2-(4-{[(4-methoxyphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)-1-(4-phenylpiperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | M056-0689 |
| Compound Name: | 2-(4-{[(4-methoxyphenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)-1-(4-phenylpiperazin-1-yl)ethan-1-one |
| Molecular Weight: | 472.61 |
| Molecular Formula: | C27 H28 N4 O2 S |
| Smiles: | COc1ccc(CSc2c3ccn(CC(N4CCN(CC4)c4ccccc4)=O)c3ccn2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8284 |
| logD: | 3.8164 |
| logSw: | -3.8991 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.182 |
| InChI Key: | IEZTUTAVUIXMRN-UHFFFAOYSA-N |