4-(4-benzylpiperidin-1-yl)-N-[(3,4-dichlorophenyl)methyl]-3-nitrobenzamide
Chemical Structure Depiction of
4-(4-benzylpiperidin-1-yl)-N-[(3,4-dichlorophenyl)methyl]-3-nitrobenzamide
4-(4-benzylpiperidin-1-yl)-N-[(3,4-dichlorophenyl)methyl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | K781-6599 |
| Compound Name: | 4-(4-benzylpiperidin-1-yl)-N-[(3,4-dichlorophenyl)methyl]-3-nitrobenzamide |
| Molecular Weight: | 498.41 |
| Molecular Formula: | C26 H25 Cl2 N3 O3 |
| Smiles: | C1CN(CCC1Cc1ccccc1)c1ccc(cc1[N+]([O-])=O)C(NCc1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.798 |
| logD: | 6.7968 |
| logSw: | -6.5444 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.612 |
| InChI Key: | AOVJEUSRFYHNCR-UHFFFAOYSA-N |