N-(4-bromophenyl)-1-{[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-1-{[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-1H-1,2,3-triazole-4-carboxamide
N-(4-bromophenyl)-1-{[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | G684-0047 |
| Compound Name: | N-(4-bromophenyl)-1-{[2-(4-ethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl}-5-methyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 496.36 |
| Molecular Formula: | C23 H22 Br N5 O3 |
| Smiles: | CCOc1ccc(cc1)c1nc(Cn2c(C)c(C(Nc3ccc(cc3)[Br])=O)nn2)c(C)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.5449 |
| logD: | 4.5392 |
| logSw: | -4.2046 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.282 |
| InChI Key: | KCHGWBMMXFRXMI-UHFFFAOYSA-N |