2-[(4-methylphenyl)sulfanyl]-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[(4-methylphenyl)sulfanyl]-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one
2-[(4-methylphenyl)sulfanyl]-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | Y032-3492 |
| Compound Name: | 2-[(4-methylphenyl)sulfanyl]-1-[4-(4-nitrophenyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 371.46 |
| Molecular Formula: | C19 H21 N3 O3 S |
| Smiles: | Cc1ccc(cc1)SCC(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8758 |
| logD: | 3.8758 |
| logSw: | -3.7891 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.001 |
| InChI Key: | BGLIUSAVULTTKB-UHFFFAOYSA-N |