N-{1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-1-oxo-3-phenylpropan-2-yl}-4-nitrobenzamide
Chemical Structure Depiction of
N-{1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-1-oxo-3-phenylpropan-2-yl}-4-nitrobenzamide
N-{1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-1-oxo-3-phenylpropan-2-yl}-4-nitrobenzamide
Compound characteristics
| Compound ID: | V014-0962 |
| Compound Name: | N-{1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-1-oxo-3-phenylpropan-2-yl}-4-nitrobenzamide |
| Molecular Weight: | 569.44 |
| Molecular Formula: | C28 H26 Cl2 N4 O5 |
| Smiles: | CC1CN(CCN1C(c1ccc(cc1[Cl])[Cl])=O)C(C(Cc1ccccc1)NC(c1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.6492 |
| logD: | 4.6491 |
| logSw: | -4.989 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.987 |
| InChI Key: | RAMCHKPVBRYGAI-UHFFFAOYSA-N |