S-(cholest-5-en-3-yl) 4-butoxybenzene-1-carbothioate
Chemical Structure Depiction of
S-(cholest-5-en-3-yl) 4-butoxybenzene-1-carbothioate
S-(cholest-5-en-3-yl) 4-butoxybenzene-1-carbothioate
Compound characteristics
| Compound ID: | 1522-0098 |
| Compound Name: | S-(cholest-5-en-3-yl) 4-butoxybenzene-1-carbothioate |
| Molecular Weight: | 578.94 |
| Molecular Formula: | C38 H58 O2 S |
| Smiles: | CCCCOc1ccc(cc1)C(=O)SC1CCC2(C)C3CCC4(C)C(CCC4C3CC=C2C1)C(C)CCCC(C)C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 11.6092 |
| logD: | 11.6092 |
| logSw: | -5.8606 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 20.9764 |
| InChI Key: | WEVIQMFAKYEXBJ-UHFFFAOYSA-N |