N-(2,4-dichlorophenyl)-4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-(2,4-dichlorophenyl)-4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide
N-(2,4-dichlorophenyl)-4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | Y508-0787 |
| Compound Name: | N-(2,4-dichlorophenyl)-4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide |
| Molecular Weight: | 419.27 |
| Molecular Formula: | C19 H16 Cl2 N4 O3 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(cc2)C(Nc2ccc(cc2[Cl])[Cl])=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0491 |
| logD: | 3.7618 |
| logSw: | -4.3396 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.693 |
| InChI Key: | APOJIPVIMWPXMD-UHFFFAOYSA-N |