N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-5-[(2,4-dichlorophenoxy)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-5-[(2,4-dichlorophenoxy)methyl]furan-2-carboxamide
N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-5-[(2,4-dichlorophenoxy)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | Y500-4355 |
| Compound Name: | N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-5-[(2,4-dichlorophenoxy)methyl]furan-2-carboxamide |
| Molecular Weight: | 495.72 |
| Molecular Formula: | C21 H14 Cl3 F N4 O3 |
| Smiles: | C(c1c(cccc1[Cl])F)n1cnc(NC(c2ccc(COc3ccc(cc3[Cl])[Cl])o2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.4823 |
| logD: | 5.4503 |
| logSw: | -6.0105 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.707 |
| InChI Key: | QQLMOAWPCXAQFM-UHFFFAOYSA-N |