1-[4-(4-nitrophenyl)piperazin-1-yl]-3-(phenylmethanesulfonyl)propan-1-one
Chemical Structure Depiction of
1-[4-(4-nitrophenyl)piperazin-1-yl]-3-(phenylmethanesulfonyl)propan-1-one
1-[4-(4-nitrophenyl)piperazin-1-yl]-3-(phenylmethanesulfonyl)propan-1-one
Compound characteristics
| Compound ID: | Y032-3843 |
| Compound Name: | 1-[4-(4-nitrophenyl)piperazin-1-yl]-3-(phenylmethanesulfonyl)propan-1-one |
| Molecular Weight: | 417.48 |
| Molecular Formula: | C20 H23 N3 O5 S |
| Smiles: | C(CS(Cc1ccccc1)(=O)=O)C(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7179 |
| logD: | 1.7179 |
| logSw: | -2.0898 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.301 |
| InChI Key: | VNTFOIJZJKFZIM-UHFFFAOYSA-N |