N-(3-chlorophenyl)-3-{1-[(4-fluorophenyl)methyl]-1H-1,2,3-triazol-4-yl}-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-3-{1-[(4-fluorophenyl)methyl]-1H-1,2,3-triazol-4-yl}-1,2,4-oxadiazole-5-carboxamide
N-(3-chlorophenyl)-3-{1-[(4-fluorophenyl)methyl]-1H-1,2,3-triazol-4-yl}-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
Compound ID: | P508-1215 |
Compound Name: | N-(3-chlorophenyl)-3-{1-[(4-fluorophenyl)methyl]-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(cc1)F)n1cc(c2nc(C(Nc3cccc(c3)[Cl])=O)on2)nn1 |
Stereo: | ACHIRAL |
logP: | 3.5923 |
logD: | 3.5877 |
logSw: | -3.8075 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 81.52 |
InChI Key: | IDERHYVIATVEIQ-UHFFFAOYSA-N |