4-tert-butyl-N-[1-(4-cyanophenyl)-5-methyl-1H-pyrazol-3-yl]benzamide
Chemical Structure Depiction of
4-tert-butyl-N-[1-(4-cyanophenyl)-5-methyl-1H-pyrazol-3-yl]benzamide
4-tert-butyl-N-[1-(4-cyanophenyl)-5-methyl-1H-pyrazol-3-yl]benzamide
Compound characteristics
| Compound ID: | V001-7270 |
| Compound Name: | 4-tert-butyl-N-[1-(4-cyanophenyl)-5-methyl-1H-pyrazol-3-yl]benzamide |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C22 H22 N4 O |
| Smiles: | Cc1cc(NC(c2ccc(cc2)C(C)(C)C)=O)nn1c1ccc(C#N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.089 |
| logD: | 5.0842 |
| logSw: | -4.9214 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.018 |
| InChI Key: | JXKYSJMBYVYALI-UHFFFAOYSA-N |