1-{[2-(5-bromo-2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-N-(2-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[2-(5-bromo-2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-N-(2-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
1-{[2-(5-bromo-2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-N-(2-methylphenyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | G684-0118 |
| Compound Name: | 1-{[2-(5-bromo-2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-N-(2-methylphenyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 496.36 |
| Molecular Formula: | C23 H22 Br N5 O3 |
| Smiles: | Cc1ccccc1NC(c1c(C)n(Cc2c(C)oc(c3cc(ccc3OC)[Br])n2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9678 |
| logD: | 3.9676 |
| logSw: | -4.1834 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.091 |
| InChI Key: | KWBVDPVYEXXHPA-UHFFFAOYSA-N |