N-{1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-1-oxo-3-phenylpropan-2-yl}-4-methylbenzamide
Chemical Structure Depiction of
N-{1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-1-oxo-3-phenylpropan-2-yl}-4-methylbenzamide
N-{1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-1-oxo-3-phenylpropan-2-yl}-4-methylbenzamide
Compound characteristics
| Compound ID: | V014-0887 |
| Compound Name: | N-{1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-1-oxo-3-phenylpropan-2-yl}-4-methylbenzamide |
| Molecular Weight: | 538.47 |
| Molecular Formula: | C29 H29 Cl2 N3 O3 |
| Smiles: | CC1CN(CCN1C(c1ccc(cc1[Cl])[Cl])=O)C(C(Cc1ccccc1)NC(c1ccc(C)cc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1469 |
| logD: | 5.1468 |
| logSw: | -5.4824 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.605 |
| InChI Key: | MXRBRWRWHVYTEO-UHFFFAOYSA-N |