ethyl 4-bromo-5-methyl-1-[4-({[4-(trifluoromethyl)phenyl]methyl}carbamoyl)phenyl]-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-bromo-5-methyl-1-[4-({[4-(trifluoromethyl)phenyl]methyl}carbamoyl)phenyl]-1H-pyrazole-3-carboxylate
ethyl 4-bromo-5-methyl-1-[4-({[4-(trifluoromethyl)phenyl]methyl}carbamoyl)phenyl]-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V003-4874 |
| Compound Name: | ethyl 4-bromo-5-methyl-1-[4-({[4-(trifluoromethyl)phenyl]methyl}carbamoyl)phenyl]-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 510.31 |
| Molecular Formula: | C22 H19 Br F3 N3 O3 |
| Smiles: | CCOC(c1c(c(C)n(c2ccc(cc2)C(NCc2ccc(cc2)C(F)(F)F)=O)n1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5688 |
| logD: | 4.5688 |
| logSw: | -4.3526 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.017 |
| InChI Key: | DOUUNKQPLXMBPW-UHFFFAOYSA-N |