N-{1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-1-oxo-3-phenylpropan-2-yl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-1-oxo-3-phenylpropan-2-yl}-2H-1,3-benzodioxole-5-carboxamide
N-{1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-1-oxo-3-phenylpropan-2-yl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V009-5569 |
| Compound Name: | N-{1-[4-(2,4-dichlorobenzoyl)-3-methylpiperazin-1-yl]-1-oxo-3-phenylpropan-2-yl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 568.46 |
| Molecular Formula: | C29 H27 Cl2 N3 O5 |
| Smiles: | CC1CN(CCN1C(c1ccc(cc1[Cl])[Cl])=O)C(C(Cc1ccccc1)NC(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.646 |
| logD: | 4.646 |
| logSw: | -4.963 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.72 |
| InChI Key: | KTBGANZPNLMXRP-UHFFFAOYSA-N |