N-[(2,5-dimethoxyphenyl)methyl]-1-(2-fluorophenyl)-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-[(2,5-dimethoxyphenyl)methyl]-1-(2-fluorophenyl)-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide
N-[(2,5-dimethoxyphenyl)methyl]-1-(2-fluorophenyl)-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L806-6449 |
| Compound Name: | N-[(2,5-dimethoxyphenyl)methyl]-1-(2-fluorophenyl)-5-(pyridin-3-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 433.44 |
| Molecular Formula: | C23 H20 F N5 O3 |
| Smiles: | COc1ccc(c(CNC(c2c(c3cccnc3)n(c3ccccc3F)nn2)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.8721 |
| logD: | 2.8721 |
| logSw: | -3.3112 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.644 |
| InChI Key: | HIJOTOCOOMMHKI-UHFFFAOYSA-N |