1-{[2-(5-bromo-2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-N-(2-chlorophenyl)-5-methyl-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}-N-(2-chlorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
1-{[2-(5-bromo-2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-N-(2-chlorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | G684-0441 |
| Compound Name: | 1-{[2-(5-bromo-2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-N-(2-chlorophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 516.78 |
| Molecular Formula: | C22 H19 Br Cl N5 O3 |
| Smiles: | Cc1c(C(Nc2ccccc2[Cl])=O)nnn1Cc1c(C)oc(c2cc(ccc2OC)[Br])n1 |
| Stereo: | ACHIRAL |
| logP: | 4.2237 |
| logD: | 4.2167 |
| logSw: | -4.4288 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.091 |
| InChI Key: | PTWXAUJXFMILCX-UHFFFAOYSA-N |