3-cyano-N-{5-methyl-1-[4-(propan-2-yl)phenyl]-1H-pyrazol-3-yl}benzamide
Chemical Structure Depiction of
3-cyano-N-{5-methyl-1-[4-(propan-2-yl)phenyl]-1H-pyrazol-3-yl}benzamide
3-cyano-N-{5-methyl-1-[4-(propan-2-yl)phenyl]-1H-pyrazol-3-yl}benzamide
Compound characteristics
| Compound ID: | V014-1422 |
| Compound Name: | 3-cyano-N-{5-methyl-1-[4-(propan-2-yl)phenyl]-1H-pyrazol-3-yl}benzamide |
| Molecular Weight: | 344.41 |
| Molecular Formula: | C21 H20 N4 O |
| Smiles: | CC(C)c1ccc(cc1)n1c(C)cc(NC(c2cccc(C#N)c2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5994 |
| logD: | 4.5525 |
| logSw: | -4.3942 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.018 |
| InChI Key: | ZRRIWFFMPJGOBI-UHFFFAOYSA-N |