N-{4-chloro-1-[(2-fluorophenyl)methyl]-1H-pyrazol-3-yl}-3-[(2,2,2-trifluoroethoxy)methyl]benzamide
Chemical Structure Depiction of
N-{4-chloro-1-[(2-fluorophenyl)methyl]-1H-pyrazol-3-yl}-3-[(2,2,2-trifluoroethoxy)methyl]benzamide
N-{4-chloro-1-[(2-fluorophenyl)methyl]-1H-pyrazol-3-yl}-3-[(2,2,2-trifluoroethoxy)methyl]benzamide
Compound characteristics
| Compound ID: | Y501-5826 |
| Compound Name: | N-{4-chloro-1-[(2-fluorophenyl)methyl]-1H-pyrazol-3-yl}-3-[(2,2,2-trifluoroethoxy)methyl]benzamide |
| Molecular Weight: | 441.81 |
| Molecular Formula: | C20 H16 Cl F4 N3 O2 |
| Smiles: | C(c1ccccc1F)n1cc(c(NC(c2cccc(COCC(F)(F)F)c2)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4861 |
| logD: | 3.2554 |
| logSw: | -4.5936 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.685 |
| InChI Key: | MXVTYUJSDRFCSE-UHFFFAOYSA-N |