5-[4-(benzyloxy)anilino]-N-(2-bromo-4-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-[4-(benzyloxy)anilino]-N-(2-bromo-4-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
5-[4-(benzyloxy)anilino]-N-(2-bromo-4-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | F414-0917 |
| Compound Name: | 5-[4-(benzyloxy)anilino]-N-(2-bromo-4-methylphenyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 478.35 |
| Molecular Formula: | C23 H20 Br N5 O2 |
| Smiles: | Cc1ccc(c(c1)[Br])NC(c1c(Nc2ccc(cc2)OCc2ccccc2)[nH]nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0975 |
| logD: | 5.0316 |
| logSw: | -5.0402 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.085 |
| InChI Key: | VCCHVAOIISZYMZ-UHFFFAOYSA-N |