2-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
2-methyl-1-(4,4,7-trimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)butan-1-one
2-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: | 3389-2370 |
| Compound Name: | 2-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: | CCC(C)C(N1c2cc(C)ccc2C2=C(C1(C)C)SSC2=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7939 |
| logD: | 4.7939 |
| logSw: | -4.5629 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 14.7059 |
| InChI Key: | ODRVVAKVXMCCFG-NSHDSACASA-N |