N-(4-bromophenyl)-1-(3-chloro-4-methylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-1-(3-chloro-4-methylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
N-(4-bromophenyl)-1-(3-chloro-4-methylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | E141-0685 |
| Compound Name: | N-(4-bromophenyl)-1-(3-chloro-4-methylphenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 405.68 |
| Molecular Formula: | C17 H14 Br Cl N4 O |
| Smiles: | Cc1ccc(cc1[Cl])n1c(C)c(C(Nc2ccc(cc2)[Br])=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.9543 |
| logD: | 4.9501 |
| logSw: | -5.0721 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.173 |
| InChI Key: | YKHSUSOLMNMUAB-UHFFFAOYSA-N |