4-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1-methyl-N-[4-(trifluoromethoxy)phenyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
4-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1-methyl-N-[4-(trifluoromethoxy)phenyl]-1H-pyrazole-3-carboxamide
4-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1-methyl-N-[4-(trifluoromethoxy)phenyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | H024-0323 |
| Compound Name: | 4-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-1-methyl-N-[4-(trifluoromethoxy)phenyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 434.37 |
| Molecular Formula: | C20 H17 F3 N4 O4 |
| Smiles: | Cn1cc(c(C(Nc2ccc(cc2)OC(F)(F)F)=O)n1)NCc1ccc2c(c1)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 3.7338 |
| logD: | 3.7338 |
| logSw: | -3.9694 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.274 |
| InChI Key: | KNHMPHZFHKADSB-UHFFFAOYSA-N |