6-[(4-chlorophenyl)sulfanyl]-2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid
Chemical Structure Depiction of
6-[(4-chlorophenyl)sulfanyl]-2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid
6-[(4-chlorophenyl)sulfanyl]-2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid
Compound characteristics
| Compound ID: | 8018-8190 |
| Compound Name: | 6-[(4-chlorophenyl)sulfanyl]-2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxylic acid |
| Molecular Weight: | 324.78 |
| Molecular Formula: | C15 H13 Cl O4 S |
| Smiles: | C1C2C3C(C1C(C2OC3=O)Sc1ccc(cc1)[Cl])C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.9524 |
| logD: | 0.0196 |
| logSw: | -3.1473 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.431 |
| InChI Key: | YEQLLKPKQRZMFA-UHFFFAOYSA-N |