N-(4-bromo-2-methylphenyl)-4-chloro-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-4-chloro-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
N-(4-bromo-2-methylphenyl)-4-chloro-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D522-0359 |
| Compound Name: | N-(4-bromo-2-methylphenyl)-4-chloro-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 396.59 |
| Molecular Formula: | C13 H10 Br Cl F3 N3 O |
| Smiles: | Cc1cc(ccc1NC(c1c(c(C(F)(F)F)n(C)n1)[Cl])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.9513 |
| logD: | 3.9449 |
| logSw: | -4.4474 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.694 |
| InChI Key: | IHTLVYCFZHOBOB-UHFFFAOYSA-N |