N-[(4-bromophenyl)methyl]-1-(3,4-dimethylphenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-[(4-bromophenyl)methyl]-1-(3,4-dimethylphenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide
N-[(4-bromophenyl)methyl]-1-(3,4-dimethylphenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L741-0262 |
| Compound Name: | N-[(4-bromophenyl)methyl]-1-(3,4-dimethylphenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 462.35 |
| Molecular Formula: | C23 H20 Br N5 O |
| Smiles: | Cc1ccc(cc1C)n1c(c2ccncc2)c(C(NCc2ccc(cc2)[Br])=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.6239 |
| logD: | 4.6238 |
| logSw: | -4.1878 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.681 |
| InChI Key: | IKYWRNDYWAMJKV-UHFFFAOYSA-N |