1-(8-ethoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-(4-fluorophenoxy)ethan-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-(4-fluorophenoxy)ethan-1-one
1-(8-ethoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-(4-fluorophenoxy)ethan-1-one
Compound characteristics
| Compound ID: | Y020-9962 |
| Compound Name: | 1-(8-ethoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-(4-fluorophenoxy)ethan-1-one |
| Molecular Weight: | 461.59 |
| Molecular Formula: | C22 H20 F N O3 S3 |
| Smiles: | CCOc1ccc2c(c1)C1=C(C(C)(C)N2C(COc2ccc(cc2)F)=O)SSC1=S |
| Stereo: | ACHIRAL |
| logP: | 4.8549 |
| logD: | 4.8549 |
| logSw: | -4.7187 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 28.5297 |
| InChI Key: | MJGQTCOBZOKMPQ-UHFFFAOYSA-N |