4-(benzenesulfonyl)-5-{[(4-methylphenyl)methyl]sulfanyl}-2-(thiophen-2-yl)-1,3-oxazole
Chemical Structure Depiction of
4-(benzenesulfonyl)-5-{[(4-methylphenyl)methyl]sulfanyl}-2-(thiophen-2-yl)-1,3-oxazole
4-(benzenesulfonyl)-5-{[(4-methylphenyl)methyl]sulfanyl}-2-(thiophen-2-yl)-1,3-oxazole
Compound characteristics
| Compound ID: | C176-0252 |
| Compound Name: | 4-(benzenesulfonyl)-5-{[(4-methylphenyl)methyl]sulfanyl}-2-(thiophen-2-yl)-1,3-oxazole |
| Molecular Weight: | 427.56 |
| Molecular Formula: | C21 H17 N O3 S3 |
| Smiles: | Cc1ccc(CSc2c(nc(c3cccs3)o2)S(c2ccccc2)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5712 |
| logD: | 5.5712 |
| logSw: | -5.5699 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.687 |
| InChI Key: | YXPAZOUBNFCRJQ-UHFFFAOYSA-N |