N-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-5-phenyl-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-5-phenyl-1,2-oxazole-3-carboxamide
N-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-5-phenyl-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | Y502-2817 |
| Compound Name: | N-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-5-phenyl-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 397.79 |
| Molecular Formula: | C19 H13 Cl F N5 O2 |
| Smiles: | C(c1ccc(cc1[Cl])F)n1cnc(NC(c2cc(c3ccccc3)on2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.3027 |
| logD: | 4.2962 |
| logSw: | -4.5502 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.087 |
| InChI Key: | IOYAHSJNDRFTCD-UHFFFAOYSA-N |