1-(8-ethoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-phenylbutan-1-one
Chemical Structure Depiction of
1-(8-ethoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-phenylbutan-1-one
1-(8-ethoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-phenylbutan-1-one
Compound characteristics
| Compound ID: | Y020-5637 |
| Compound Name: | 1-(8-ethoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-phenylbutan-1-one |
| Molecular Weight: | 455.66 |
| Molecular Formula: | C24 H25 N O2 S3 |
| Smiles: | CCC(C(N1c2ccc(cc2C2=C(C1(C)C)SSC2=S)OCC)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0049 |
| logD: | 6.0049 |
| logSw: | -5.5991 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 21.558 |
| InChI Key: | VMJKDVZIUQFSQF-QGZVFWFLSA-N |