N-[(3,4-diethoxyphenyl)methyl]-1-(4-fluorophenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-[(3,4-diethoxyphenyl)methyl]-1-(4-fluorophenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide
N-[(3,4-diethoxyphenyl)methyl]-1-(4-fluorophenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L741-0396 |
| Compound Name: | N-[(3,4-diethoxyphenyl)methyl]-1-(4-fluorophenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 461.5 |
| Molecular Formula: | C25 H24 F N5 O3 |
| Smiles: | CCOc1ccc(CNC(c2c(c3ccncc3)n(c3ccc(cc3)F)nn2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 2.7977 |
| logD: | 2.7976 |
| logSw: | -2.9856 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.101 |
| InChI Key: | PWDRUBCCCPMWRH-UHFFFAOYSA-N |