17-thiabicyclo[12.2.1]heptadeca-1(16),14-diene-2,13-dione
Chemical Structure Depiction of
17-thiabicyclo[12.2.1]heptadeca-1(16),14-diene-2,13-dione
17-thiabicyclo[12.2.1]heptadeca-1(16),14-diene-2,13-dione
Compound characteristics
| Compound ID: | 8020-0589 |
| Compound Name: | 17-thiabicyclo[12.2.1]heptadeca-1(16),14-diene-2,13-dione |
| Molecular Weight: | 278.41 |
| Molecular Formula: | C16 H22 O2 S |
| Smiles: | C1CCCCCC(c2ccc(C(CCCC1)=O)s2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2948 |
| logD: | 5.2948 |
| logSw: | -5.4172 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.0042 |
| InChI Key: | ODBUSOJDFGSMTM-UHFFFAOYSA-N |