1-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-phenylbutan-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-phenylbutan-1-one
1-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-phenylbutan-1-one
Compound characteristics
| Compound ID: | Y020-5636 |
| Compound Name: | 1-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-phenylbutan-1-one |
| Molecular Weight: | 441.63 |
| Molecular Formula: | C23 H23 N O2 S3 |
| Smiles: | CCC(C(N1c2ccc(cc2C2=C(C1(C)C)SSC2=S)OC)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6175 |
| logD: | 5.6175 |
| logSw: | -5.5342 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 21.9781 |
| InChI Key: | LAOSKSVUWLAUEG-MRXNPFEDSA-N |