1-(4-methylphenyl)-2-(9H-thioxanthen-9-yl)butane-1,3-dione
Chemical Structure Depiction of
1-(4-methylphenyl)-2-(9H-thioxanthen-9-yl)butane-1,3-dione
1-(4-methylphenyl)-2-(9H-thioxanthen-9-yl)butane-1,3-dione
Compound characteristics
| Compound ID: | 7746-0012 |
| Compound Name: | 1-(4-methylphenyl)-2-(9H-thioxanthen-9-yl)butane-1,3-dione |
| Molecular Weight: | 372.48 |
| Molecular Formula: | C24 H20 O2 S |
| Smiles: | CC(C(C1c2ccccc2Sc2ccccc12)C(c1ccc(C)cc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2927 |
| logD: | 5.2034 |
| logSw: | -5.4109 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 27.1812 |
| InChI Key: | ITQUHOKZWURZLM-JOCHJYFZSA-N |