N-[(3-chloro-4-fluorophenyl)methyl]-1-(4-fluorophenyl)-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-[(3-chloro-4-fluorophenyl)methyl]-1-(4-fluorophenyl)-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide
N-[(3-chloro-4-fluorophenyl)methyl]-1-(4-fluorophenyl)-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L806-0190 |
| Compound Name: | N-[(3-chloro-4-fluorophenyl)methyl]-1-(4-fluorophenyl)-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 425.82 |
| Molecular Formula: | C21 H14 Cl F2 N5 O |
| Smiles: | C(c1ccc(c(c1)[Cl])F)NC(c1c(c2cccnc2)n(c2ccc(cc2)F)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3368 |
| logD: | 3.3368 |
| logSw: | -3.6252 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.771 |
| InChI Key: | ROCULQPTCKZVRV-UHFFFAOYSA-N |