1-{[2-(5-bromo-2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-N-(2,4,6-trimethylphenyl)-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-(2,4,6-trimethylphenyl)-1H-1,2,3-triazole-4-carboxamide
1-{[2-(5-bromo-2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-N-(2,4,6-trimethylphenyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | G684-0589 |
| Compound Name: | 1-{[2-(5-bromo-2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-N-(2,4,6-trimethylphenyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 524.42 |
| Molecular Formula: | C25 H26 Br N5 O3 |
| Smiles: | Cc1cc(C)c(c(C)c1)NC(c1c(C)n(Cc2c(C)oc(c3cc(ccc3OC)[Br])n2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3506 |
| logD: | 4.3502 |
| logSw: | -4.3653 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.393 |
| InChI Key: | WVWLAQXTFSGKNA-UHFFFAOYSA-N |