1-benzyl-4-{2-nitro-5-[4-(phenylmethanesulfonyl)piperazin-1-yl]phenyl}piperazine
Chemical Structure Depiction of
1-benzyl-4-{2-nitro-5-[4-(phenylmethanesulfonyl)piperazin-1-yl]phenyl}piperazine
1-benzyl-4-{2-nitro-5-[4-(phenylmethanesulfonyl)piperazin-1-yl]phenyl}piperazine
Compound characteristics
| Compound ID: | 8014-2960 |
| Compound Name: | 1-benzyl-4-{2-nitro-5-[4-(phenylmethanesulfonyl)piperazin-1-yl]phenyl}piperazine |
| Molecular Weight: | 535.67 |
| Molecular Formula: | C28 H33 N5 O4 S |
| Smiles: | C1CN(CCN1Cc1ccccc1)c1cc(ccc1[N+]([O-])=O)N1CCN(CC1)S(Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8575 |
| logD: | 3.7805 |
| logSw: | -4.144 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.877 |
| InChI Key: | OBMPLJBAUQJWCR-UHFFFAOYSA-N |