2-ethyl-1-(4,4,7,8-tetramethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)butan-1-one
Chemical Structure Depiction of
2-ethyl-1-(4,4,7,8-tetramethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)butan-1-one
2-ethyl-1-(4,4,7,8-tetramethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)butan-1-one
Compound characteristics
| Compound ID: | 3785-0044 |
| Compound Name: | 2-ethyl-1-(4,4,7,8-tetramethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)butan-1-one |
| Molecular Weight: | 391.62 |
| Molecular Formula: | C20 H25 N O S3 |
| Smiles: | CCC(CC)C(N1c2cc(C)c(C)cc2C2=C(C1(C)C)SSC2=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8433 |
| logD: | 5.8433 |
| logSw: | -5.4333 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 14.7059 |
| InChI Key: | VDJPZCXHXPMKHN-UHFFFAOYSA-N |