2-chloro-1-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)propan-1-one
Chemical Structure Depiction of
2-chloro-1-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)propan-1-one
2-chloro-1-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)propan-1-one
Compound characteristics
| Compound ID: | Y020-5264 |
| Compound Name: | 2-chloro-1-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)propan-1-one |
| Molecular Weight: | 385.95 |
| Molecular Formula: | C16 H16 Cl N O2 S3 |
| Smiles: | CC(C(N1c2ccc(cc2C2=C(C1(C)C)SSC2=S)OC)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9901 |
| logD: | 3.9901 |
| logSw: | -4.408 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 22.2497 |
| InChI Key: | COYQGLDSERQIPS-QMMMGPOBSA-N |