N-[3-tert-butyl-1-(2-chlorophenyl)-1H-pyrazol-5-yl]-2,4-bis(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-[3-tert-butyl-1-(2-chlorophenyl)-1H-pyrazol-5-yl]-2,4-bis(trifluoromethyl)benzamide
N-[3-tert-butyl-1-(2-chlorophenyl)-1H-pyrazol-5-yl]-2,4-bis(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V012-4280 |
| Compound Name: | N-[3-tert-butyl-1-(2-chlorophenyl)-1H-pyrazol-5-yl]-2,4-bis(trifluoromethyl)benzamide |
| Molecular Weight: | 489.85 |
| Molecular Formula: | C22 H18 Cl F6 N3 O |
| Smiles: | CC(C)(C)c1cc(NC(c2ccc(cc2C(F)(F)F)C(F)(F)F)=O)n(c2ccccc2[Cl])n1 |
| Stereo: | ACHIRAL |
| logP: | 7.0346 |
| logD: | 4.9799 |
| logSw: | -6.3121 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.464 |
| InChI Key: | KHOHSQISAVHSNH-UHFFFAOYSA-N |