2-[2-bromo-4-(propan-2-yl)phenoxy]-N-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}acetamide
Chemical Structure Depiction of
2-[2-bromo-4-(propan-2-yl)phenoxy]-N-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}acetamide
2-[2-bromo-4-(propan-2-yl)phenoxy]-N-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}acetamide
Compound characteristics
| Compound ID: | D101-0510 |
| Compound Name: | 2-[2-bromo-4-(propan-2-yl)phenoxy]-N-{[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}acetamide |
| Molecular Weight: | 444.33 |
| Molecular Formula: | C21 H22 Br N3 O3 |
| Smiles: | CC(C)c1ccc(c(c1)[Br])OCC(NCc1nc(c2ccc(C)cc2)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4925 |
| logD: | 5.4925 |
| logSw: | -5.4383 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.367 |
| InChI Key: | ZDNDMQBNBKXAIZ-UHFFFAOYSA-N |