N-[(3-bromophenyl)methyl]-1-(2-methylphenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-[(3-bromophenyl)methyl]-1-(2-methylphenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide
N-[(3-bromophenyl)methyl]-1-(2-methylphenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | L741-3182 |
| Compound Name: | N-[(3-bromophenyl)methyl]-1-(2-methylphenyl)-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 448.32 |
| Molecular Formula: | C22 H18 Br N5 O |
| Smiles: | Cc1ccccc1n1c(c2ccncc2)c(C(NCc2cccc(c2)[Br])=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 3.8001 |
| logD: | 3.8001 |
| logSw: | -3.8742 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.38 |
| InChI Key: | JLOGQGOSSCXCTH-UHFFFAOYSA-N |