N-[(4-methylphenyl)methyl]-3-nitro-4-(piperidin-1-yl)benzamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-3-nitro-4-(piperidin-1-yl)benzamide
N-[(4-methylphenyl)methyl]-3-nitro-4-(piperidin-1-yl)benzamide
Compound characteristics
| Compound ID: | K781-6469 |
| Compound Name: | N-[(4-methylphenyl)methyl]-3-nitro-4-(piperidin-1-yl)benzamide |
| Molecular Weight: | 353.42 |
| Molecular Formula: | C20 H23 N3 O3 |
| Smiles: | Cc1ccc(CNC(c2ccc(c(c2)[N+]([O-])=O)N2CCCCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8916 |
| logD: | 3.8911 |
| logSw: | -3.9362 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.884 |
| InChI Key: | NHEFWKWPBAQJTK-UHFFFAOYSA-N |