N-(2-chlorophenyl)-2H-[3,4'-bi-1,2,4-triazole]-5-carboxamide
Chemical Structure Depiction of
N-(2-chlorophenyl)-2H-[3,4'-bi-1,2,4-triazole]-5-carboxamide
N-(2-chlorophenyl)-2H-[3,4'-bi-1,2,4-triazole]-5-carboxamide
Compound characteristics
Compound ID: | 8018-6924 |
Compound Name: | N-(2-chlorophenyl)-2H-[3,4'-bi-1,2,4-triazole]-5-carboxamide |
Molecular Weight: | 289.68 |
Molecular Formula: | C11 H8 Cl N7 O |
Smiles: | c1ccc(c(c1)NC(c1nc([nH]n1)n1cnnc1)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 0.818 |
logD: | 0.7732 |
logSw: | -2.2187 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 81.647 |
InChI Key: | PLIAVRYEEFDVAK-UHFFFAOYSA-N |