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 |