2-[4-(benzylsulfanyl)-1H-pyrrolo[3,2-c]pyridin-1-yl]-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[4-(benzylsulfanyl)-1H-pyrrolo[3,2-c]pyridin-1-yl]-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethan-1-one
2-[4-(benzylsulfanyl)-1H-pyrrolo[3,2-c]pyridin-1-yl]-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | M056-0546 |
| Compound Name: | 2-[4-(benzylsulfanyl)-1H-pyrrolo[3,2-c]pyridin-1-yl]-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 472.61 |
| Molecular Formula: | C27 H28 N4 O2 S |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)C(Cn1ccc2c(nccc12)SCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9499 |
| logD: | 3.938 |
| logSw: | -3.9762 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.182 |
| InChI Key: | KTDGVYSYJCZWQM-UHFFFAOYSA-N |