2-{[4-(4-methylbenzene-1-sulfonyl)-2-(4-methylphenyl)-1,3-oxazol-5-yl]sulfanyl}-1-phenylethan-1-one
Chemical Structure Depiction of
2-{[4-(4-methylbenzene-1-sulfonyl)-2-(4-methylphenyl)-1,3-oxazol-5-yl]sulfanyl}-1-phenylethan-1-one
2-{[4-(4-methylbenzene-1-sulfonyl)-2-(4-methylphenyl)-1,3-oxazol-5-yl]sulfanyl}-1-phenylethan-1-one
Compound characteristics
| Compound ID: | C176-0117 |
| Compound Name: | 2-{[4-(4-methylbenzene-1-sulfonyl)-2-(4-methylphenyl)-1,3-oxazol-5-yl]sulfanyl}-1-phenylethan-1-one |
| Molecular Weight: | 463.57 |
| Molecular Formula: | C25 H21 N O4 S2 |
| Smiles: | Cc1ccc(cc1)c1nc(c(o1)SCC(c1ccccc1)=O)S(c1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0356 |
| logD: | 6.0356 |
| logSw: | -5.651 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.915 |
| InChI Key: | BQNINOVRUZPLKQ-UHFFFAOYSA-N |