S-(cholest-5-en-3-yl) cyclohexanecarbothioate
Chemical Structure Depiction of
S-(cholest-5-en-3-yl) cyclohexanecarbothioate
S-(cholest-5-en-3-yl) cyclohexanecarbothioate
Compound characteristics
| Compound ID: | 0242-0953 |
| Compound Name: | S-(cholest-5-en-3-yl) cyclohexanecarbothioate |
| Molecular Weight: | 512.88 |
| Molecular Formula: | C34 H56 O S |
| Smiles: | CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)SC(C1CCCCC1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 10.422 |
| logD: | 10.422 |
| logSw: | -5.9751 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 13.7508 |
| InChI Key: | JKUPOCUMJTXCDM-UHFFFAOYSA-N |