N-benzyl-2-(4-chlorophenyl)-5-(hydroxymethyl)-2H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-2-(4-chlorophenyl)-5-(hydroxymethyl)-2H-1,2,3-triazole-4-carboxamide
N-benzyl-2-(4-chlorophenyl)-5-(hydroxymethyl)-2H-1,2,3-triazole-4-carboxamide
Compound characteristics
Compound ID: | D217-0308 |
Compound Name: | N-benzyl-2-(4-chlorophenyl)-5-(hydroxymethyl)-2H-1,2,3-triazole-4-carboxamide |
Molecular Weight: | 342.78 |
Molecular Formula: | C17 H15 Cl N4 O2 |
Smiles: | C(c1ccccc1)NC(c1c(CO)nn(c2ccc(cc2)[Cl])n1)=O |
Stereo: | ACHIRAL |
logP: | 2.245 |
logD: | 2.245 |
logSw: | -2.9426 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 68.136 |
InChI Key: | UNIZIFDAHOWBQL-UHFFFAOYSA-N |