4-(4-bromobenzene-1-sulfonyl)-5-[(2-methylpropyl)sulfanyl]-2-(thiophen-2-yl)-1,3-oxazole
Chemical Structure Depiction of
4-(4-bromobenzene-1-sulfonyl)-5-[(2-methylpropyl)sulfanyl]-2-(thiophen-2-yl)-1,3-oxazole
4-(4-bromobenzene-1-sulfonyl)-5-[(2-methylpropyl)sulfanyl]-2-(thiophen-2-yl)-1,3-oxazole
Compound characteristics
| Compound ID: | C176-0346 |
| Compound Name: | 4-(4-bromobenzene-1-sulfonyl)-5-[(2-methylpropyl)sulfanyl]-2-(thiophen-2-yl)-1,3-oxazole |
| Molecular Weight: | 458.41 |
| Molecular Formula: | C17 H16 Br N O3 S3 |
| Smiles: | CC(C)CSc1c(nc(c2cccs2)o1)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1846 |
| logD: | 6.1846 |
| logSw: | -5.6644 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.958 |
| InChI Key: | CBXDHZOPYZBTAF-UHFFFAOYSA-N |