3-methyl-1-(4,4,7-trimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)butan-1-one
Chemical Structure Depiction of
3-methyl-1-(4,4,7-trimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)butan-1-one
3-methyl-1-(4,4,7-trimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)butan-1-one
Compound characteristics
| Compound ID: | Y020-5780 |
| Compound Name: | 3-methyl-1-(4,4,7-trimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)butan-1-one |
| Molecular Weight: | 363.56 |
| Molecular Formula: | C18 H21 N O S3 |
| Smiles: | CC(C)CC(N1c2cc(C)ccc2C2=C(C1(C)C)SSC2=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8216 |
| logD: | 4.8216 |
| logSw: | -4.5713 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 14.1785 |
| InChI Key: | FGMKEEVYPGKPED-UHFFFAOYSA-N |