5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(3,4-difluorophenyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(3,4-difluorophenyl)-1H-1,2,3-triazole-4-carboxamide
5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(3,4-difluorophenyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C549-0379 |
| Compound Name: | 5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(3,4-difluorophenyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 426.19 |
| Molecular Formula: | C16 H11 Br F3 N5 O |
| Smiles: | C(c1ccc(cc1F)[Br])n1c(c(C(Nc2ccc(c(c2)F)F)=O)nn1)N |
| Stereo: | ACHIRAL |
| logP: | 3.5404 |
| logD: | 3.5202 |
| logSw: | -3.7231 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.287 |
| InChI Key: | YUVBXHARYHNWDB-UHFFFAOYSA-N |