N-(2-butylphenyl)-4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzamide
Chemical Structure Depiction of
N-(2-butylphenyl)-4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzamide
N-(2-butylphenyl)-4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzamide
Compound characteristics
| Compound ID: | Y500-6320 |
| Compound Name: | N-(2-butylphenyl)-4-[(4-chloro-1H-pyrazol-1-yl)methyl]benzamide |
| Molecular Weight: | 367.88 |
| Molecular Formula: | C21 H22 Cl N3 O |
| Smiles: | CCCCc1ccccc1NC(c1ccc(Cn2cc(cn2)[Cl])cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9756 |
| logD: | 4.9755 |
| logSw: | -4.9726 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.137 |
| InChI Key: | VWBWDDKFROIHIR-UHFFFAOYSA-N |