1-[(2-chlorophenyl)methyl]-N-(3,5-difluorophenyl)-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-[(2-chlorophenyl)methyl]-N-(3,5-difluorophenyl)-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
1-[(2-chlorophenyl)methyl]-N-(3,5-difluorophenyl)-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L116-1818 |
| Compound Name: | 1-[(2-chlorophenyl)methyl]-N-(3,5-difluorophenyl)-5-(1H-pyrrol-1-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 413.81 |
| Molecular Formula: | C20 H14 Cl F2 N5 O |
| Smiles: | C(c1ccccc1[Cl])n1c(c(C(Nc2cc(cc(c2)F)F)=O)nn1)n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8882 |
| logD: | 4.8785 |
| logSw: | -5.0502 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.828 |
| InChI Key: | AJTWNYIIBFKAQU-UHFFFAOYSA-N |