N-{1-[(2,6-dichlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-[(2,4-difluorophenoxy)methyl]-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-{1-[(2,6-dichlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-[(2,4-difluorophenoxy)methyl]-1H-pyrazole-3-carboxamide
N-{1-[(2,6-dichlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-[(2,4-difluorophenoxy)methyl]-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y502-1004 |
| Compound Name: | N-{1-[(2,6-dichlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-[(2,4-difluorophenoxy)methyl]-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 479.27 |
| Molecular Formula: | C20 H14 Cl2 F2 N6 O2 |
| Smiles: | C(c1c(cccc1[Cl])[Cl])n1cnc(NC(c2ccn(COc3ccc(cc3F)F)n2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.2391 |
| logD: | 4.2176 |
| logSw: | -4.5297 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.001 |
| InChI Key: | FVNKVEBMPBAYBN-UHFFFAOYSA-N |