(4-chlorophenyl)(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)methanone
Chemical Structure Depiction of
(4-chlorophenyl)(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)methanone
(4-chlorophenyl)(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)methanone
Compound characteristics
| Compound ID: | Y021-2162 |
| Compound Name: | (4-chlorophenyl)(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)methanone |
| Molecular Weight: | 434 |
| Molecular Formula: | C20 H16 Cl N O2 S3 |
| Smiles: | CC1(C)C2=C(C(=S)SS2)c2cc(ccc2N1C(c1ccc(cc1)[Cl])=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.2625 |
| logD: | 5.2625 |
| logSw: | -5.7362 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 21.9781 |
| InChI Key: | KSIQCDSSWXJOLB-UHFFFAOYSA-N |