4-chloro-N-(2-{5-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzamide
Chemical Structure Depiction of
4-chloro-N-(2-{5-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzamide
4-chloro-N-(2-{5-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzamide
Compound characteristics
Compound ID: | G717-2157 |
Compound Name: | 4-chloro-N-(2-{5-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzamide |
Molecular Weight: | 358.8 |
Molecular Formula: | C18 H16 Cl F N4 O |
Smiles: | C(CNC(c1ccc(cc1)[Cl])=O)c1nc(Cc2ccc(cc2)F)[nH]n1 |
Stereo: | ACHIRAL |
logP: | 3.3318 |
logD: | 3.3304 |
logSw: | -3.9476 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 60.259 |
InChI Key: | AMUZTFGLEDKSJN-UHFFFAOYSA-N |