5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(5-chloro-2-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(5-chloro-2-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(5-chloro-2-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | C200-2233 |
| Compound Name: | 5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(5-chloro-2-methoxyphenyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 454.68 |
| Molecular Formula: | C17 H14 Br Cl F N5 O2 |
| Smiles: | COc1ccc(cc1NC(c1c(N)n(Cc2ccc(cc2F)[Br])nn1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.6348 |
| logD: | 3.6257 |
| logSw: | -4.0676 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.22 |
| InChI Key: | KZJRQIKMMVNJPZ-UHFFFAOYSA-N |