N-[(4-chlorophenyl)methyl]-2-(4-fluorophenyl)-5-(hydroxymethyl)-2H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-(4-fluorophenyl)-5-(hydroxymethyl)-2H-1,2,3-triazole-4-carboxamide
N-[(4-chlorophenyl)methyl]-2-(4-fluorophenyl)-5-(hydroxymethyl)-2H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | D217-0407 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-(4-fluorophenyl)-5-(hydroxymethyl)-2H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 360.77 |
| Molecular Formula: | C17 H14 Cl F N4 O2 |
| Smiles: | C(c1ccc(cc1)[Cl])NC(c1c(CO)nn(c2ccc(cc2)F)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2741 |
| logD: | 2.274 |
| logSw: | -3.0456 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.136 |
| InChI Key: | MROLEVIWTVEERW-UHFFFAOYSA-N |