1-(4-chlorophenyl)-N,N-bis(2-hydroxyethyl)-5-phenyl-1H-1,2,4-triazole-3-carboxamide
Chemical Structure Depiction of
1-(4-chlorophenyl)-N,N-bis(2-hydroxyethyl)-5-phenyl-1H-1,2,4-triazole-3-carboxamide
1-(4-chlorophenyl)-N,N-bis(2-hydroxyethyl)-5-phenyl-1H-1,2,4-triazole-3-carboxamide
Compound characteristics
Compound ID: | D351-2135 |
Compound Name: | 1-(4-chlorophenyl)-N,N-bis(2-hydroxyethyl)-5-phenyl-1H-1,2,4-triazole-3-carboxamide |
Molecular Weight: | 386.84 |
Molecular Formula: | C19 H19 Cl N4 O3 |
Smiles: | C(CO)N(CCO)C(c1nc(c2ccccc2)n(c2ccc(cc2)[Cl])n1)=O |
Stereo: | ACHIRAL |
logP: | 2.6371 |
logD: | 2.6371 |
logSw: | -3.3036 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 73.64 |
InChI Key: | JZFAKBFEGZFUIU-UHFFFAOYSA-N |