1-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethan-1-one
1-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | 3807-5281 |
| Compound Name: | 1-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 467.67 |
| Molecular Formula: | C18 H17 N3 O2 S5 |
| Smiles: | Cc1nnc(SCC(N2c3ccc(cc3C3=C(C2(C)C)SSC3=S)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.7282 |
| logD: | 3.7282 |
| logSw: | -4.1394 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 44.122 |
| InChI Key: | OECYYTMBHJYUJJ-UHFFFAOYSA-N |