N-[(3-chloro-4-fluorophenyl)methyl]-3-(1-phenyl-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[(3-chloro-4-fluorophenyl)methyl]-3-(1-phenyl-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazole-5-carboxamide
N-[(3-chloro-4-fluorophenyl)methyl]-3-(1-phenyl-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | P508-1397 |
| Compound Name: | N-[(3-chloro-4-fluorophenyl)methyl]-3-(1-phenyl-1H-1,2,3-triazol-4-yl)-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 398.78 |
| Molecular Formula: | C18 H12 Cl F N6 O2 |
| Smiles: | C(c1ccc(c(c1)[Cl])F)NC(c1nc(c2cn(c3ccccc3)nn2)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1799 |
| logD: | 3.1798 |
| logSw: | -3.4841 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.694 |
| InChI Key: | JBSYJWRGSCELCS-UHFFFAOYSA-N |