3-phenyl-1-(4,4,6-trimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)propan-1-one
Chemical Structure Depiction of
3-phenyl-1-(4,4,6-trimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)propan-1-one
3-phenyl-1-(4,4,6-trimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)propan-1-one
Compound characteristics
| Compound ID: | Y020-9991 |
| Compound Name: | 3-phenyl-1-(4,4,6-trimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)propan-1-one |
| Molecular Weight: | 411.61 |
| Molecular Formula: | C22 H21 N O S3 |
| Smiles: | Cc1cccc2C3=C(C(C)(C)N(C(CCc4ccccc4)=O)c12)SSC3=S |
| Stereo: | ACHIRAL |
| logP: | 5.3137 |
| logD: | 5.3137 |
| logSw: | -5.3306 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 15.0642 |
| InChI Key: | HVHJRYAXDAZYRT-UHFFFAOYSA-N |