2-{[4-(4-chlorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-yl]sulfanyl}-1-(4-chlorophenyl)ethan-1-one
Chemical Structure Depiction of
2-{[4-(4-chlorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-yl]sulfanyl}-1-(4-chlorophenyl)ethan-1-one
2-{[4-(4-chlorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-yl]sulfanyl}-1-(4-chlorophenyl)ethan-1-one
Compound characteristics
| Compound ID: | C176-0324 |
| Compound Name: | 2-{[4-(4-chlorobenzene-1-sulfonyl)-2-(thiophen-2-yl)-1,3-oxazol-5-yl]sulfanyl}-1-(4-chlorophenyl)ethan-1-one |
| Molecular Weight: | 510.44 |
| Molecular Formula: | C21 H13 Cl2 N O4 S3 |
| Smiles: | C(C(c1ccc(cc1)[Cl])=O)Sc1c(nc(c2cccs2)o1)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.325 |
| logD: | 6.325 |
| logSw: | -6.4349 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.934 |
| InChI Key: | XVAUPJRERGEWHR-UHFFFAOYSA-N |