N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-[(2,4-difluorophenoxy)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-[(2,4-difluorophenoxy)methyl]-1H-pyrazole-3-carboxamide
N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-[(2,4-difluorophenoxy)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y502-1002 |
| Compound Name: | N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-[(2,4-difluorophenoxy)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 444.83 |
| Molecular Formula: | C20 H15 Cl F2 N6 O2 |
| Smiles: | C(c1ccc(cc1)[Cl])n1cnc(NC(c2ccn(COc3ccc(cc3F)F)n2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.6082 |
| logD: | 3.5868 |
| logSw: | -3.9416 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.001 |
| InChI Key: | GHXDMHVVYPWHPD-UHFFFAOYSA-N |