2-{[4-(4-bromobenzene-1-sulfonyl)-2-phenyl-1,3-oxazol-5-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{[4-(4-bromobenzene-1-sulfonyl)-2-phenyl-1,3-oxazol-5-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]acetamide
2-{[4-(4-bromobenzene-1-sulfonyl)-2-phenyl-1,3-oxazol-5-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C176-0077 |
| Compound Name: | 2-{[4-(4-bromobenzene-1-sulfonyl)-2-phenyl-1,3-oxazol-5-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 537.45 |
| Molecular Formula: | C22 H21 Br N2 O5 S2 |
| Smiles: | C1CC(CNC(CSc2c(nc(c3ccccc3)o2)S(c2ccc(cc2)[Br])(=O)=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0323 |
| logD: | 4.0323 |
| logSw: | -4.1118 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.794 |
| InChI Key: | HOVCFQHCLYCFIK-QGZVFWFLSA-N |