N-(4-bromophenyl)-5-methyl-1-[4-(propan-2-yl)phenyl]-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-5-methyl-1-[4-(propan-2-yl)phenyl]-1H-1,2,3-triazole-4-carboxamide
N-(4-bromophenyl)-5-methyl-1-[4-(propan-2-yl)phenyl]-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | E141-1421 |
| Compound Name: | N-(4-bromophenyl)-5-methyl-1-[4-(propan-2-yl)phenyl]-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 399.29 |
| Molecular Formula: | C19 H19 Br N4 O |
| Smiles: | CC(C)c1ccc(cc1)n1c(C)c(C(Nc2ccc(cc2)[Br])=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 5.0427 |
| logD: | 5.0384 |
| logSw: | -4.612 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.173 |
| InChI Key: | RQHVIDRSZKHPEK-UHFFFAOYSA-N |