ethyl 5-(3-methylbutyl)-1-[4-({[4-(trifluoromethyl)phenyl]methyl}carbamoyl)phenyl]-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(3-methylbutyl)-1-[4-({[4-(trifluoromethyl)phenyl]methyl}carbamoyl)phenyl]-1H-pyrazole-3-carboxylate
ethyl 5-(3-methylbutyl)-1-[4-({[4-(trifluoromethyl)phenyl]methyl}carbamoyl)phenyl]-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V016-6070 |
| Compound Name: | ethyl 5-(3-methylbutyl)-1-[4-({[4-(trifluoromethyl)phenyl]methyl}carbamoyl)phenyl]-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 487.52 |
| Molecular Formula: | C26 H28 F3 N3 O3 |
| Smiles: | CCOC(c1cc(CCC(C)C)n(c2ccc(cc2)C(NCc2ccc(cc2)C(F)(F)F)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7294 |
| logD: | 5.7293 |
| logSw: | -5.4445 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.981 |
| InChI Key: | WAKRCRNNQUGODU-UHFFFAOYSA-N |