2-{[(4-chlorophenyl)methyl]sulfanyl}-1-(4-ethylpiperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{[(4-chlorophenyl)methyl]sulfanyl}-1-(4-ethylpiperazin-1-yl)ethan-1-one
2-{[(4-chlorophenyl)methyl]sulfanyl}-1-(4-ethylpiperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | Y031-3564 |
| Compound Name: | 2-{[(4-chlorophenyl)methyl]sulfanyl}-1-(4-ethylpiperazin-1-yl)ethan-1-one |
| Molecular Weight: | 312.86 |
| Molecular Formula: | C15 H21 Cl N2 O S |
| Smiles: | CCN1CCN(CC1)C(CSCc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5766 |
| logD: | 2.4576 |
| logSw: | -2.9626 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 19.8961 |
| InChI Key: | NRCOARHQGYOYMP-UHFFFAOYSA-N |