{4-[(3-chlorophenyl)sulfanyl]-3-nitrophenyl}(4-phenylpiperazin-1-yl)methanone
Chemical Structure Depiction of
{4-[(3-chlorophenyl)sulfanyl]-3-nitrophenyl}(4-phenylpiperazin-1-yl)methanone
{4-[(3-chlorophenyl)sulfanyl]-3-nitrophenyl}(4-phenylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | K672-0356 |
| Compound Name: | {4-[(3-chlorophenyl)sulfanyl]-3-nitrophenyl}(4-phenylpiperazin-1-yl)methanone |
| Molecular Weight: | 453.95 |
| Molecular Formula: | C23 H20 Cl N3 O3 S |
| Smiles: | C1CN(CCN1C(c1ccc(c(c1)[N+]([O-])=O)Sc1cccc(c1)[Cl])=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4299 |
| logD: | 5.4299 |
| logSw: | -5.9509 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.956 |
| InChI Key: | KIHUSCFPOJUEJA-UHFFFAOYSA-N |