N-(4-bromophenyl)-4-chloro-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-4-chloro-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
N-(4-bromophenyl)-4-chloro-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | D522-0416 |
| Compound Name: | N-(4-bromophenyl)-4-chloro-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 382.56 |
| Molecular Formula: | C12 H8 Br Cl F3 N3 O |
| Smiles: | Cn1c(c(c(C(Nc2ccc(cc2)[Br])=O)n1)[Cl])C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.7688 |
| logD: | 3.765 |
| logSw: | -4.3568 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.392 |
| InChI Key: | CMCZMUNKJUNPFK-UHFFFAOYSA-N |