2-(4-{[(4-fluorophenyl)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-fluorophenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)-1-(4-phenylpiperazin-1-yl)ethan-1-one
2-(4-{[(4-fluorophenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)-1-(4-phenylpiperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | M056-0054 |
| Compound Name: | 2-(4-{[(4-fluorophenyl)methyl]sulfanyl}-1H-pyrrolo[3,2-c]pyridin-1-yl)-1-(4-phenylpiperazin-1-yl)ethan-1-one |
| Molecular Weight: | 460.57 |
| Molecular Formula: | C26 H25 F N4 O S |
| Smiles: | C1CN(CCN1C(Cn1ccc2c(nccc12)SCc1ccc(cc1)F)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8751 |
| logD: | 3.8631 |
| logSw: | -3.9629 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.638 |
| InChI Key: | JEKWQPIVFUHCRB-UHFFFAOYSA-N |