N-(3-chloro-4-fluorophenyl)-5-(4-methylanilino)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-5-(4-methylanilino)-1H-1,2,3-triazole-4-carboxamide
N-(3-chloro-4-fluorophenyl)-5-(4-methylanilino)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
Compound ID: | F414-0069 |
Compound Name: | N-(3-chloro-4-fluorophenyl)-5-(4-methylanilino)-1H-1,2,3-triazole-4-carboxamide |
Molecular Weight: | 345.76 |
Molecular Formula: | C16 H13 Cl F N5 O |
Smiles: | Cc1ccc(cc1)Nc1c(C(Nc2ccc(c(c2)[Cl])F)=O)nn[nH]1 |
Stereo: | ACHIRAL |
logP: | 3.8571 |
logD: | 3.7912 |
logSw: | -4.2726 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 69.555 |
InChI Key: | WCRKUWIFDZYXTR-UHFFFAOYSA-N |