4-bromo-N-(3-cyanothiophen-2-yl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
4-bromo-N-(3-cyanothiophen-2-yl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
4-bromo-N-(3-cyanothiophen-2-yl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y502-4701 |
| Compound Name: | 4-bromo-N-(3-cyanothiophen-2-yl)-1-methyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 379.15 |
| Molecular Formula: | C11 H6 Br F3 N4 O S |
| Smiles: | Cn1c(c(c(C(Nc2c(C#N)ccs2)=O)n1)[Br])C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 2.2526 |
| logD: | 1.6775 |
| logSw: | -3.0642 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.243 |
| InChI Key: | KOVCBEAFELAJHG-UHFFFAOYSA-N |