1-(6-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-phenylethan-1-one
Chemical Structure Depiction of
1-(6-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-phenylethan-1-one
1-(6-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-phenylethan-1-one
Compound characteristics
| Compound ID: | 3389-1915 |
| Compound Name: | 1-(6-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-phenylethan-1-one |
| Molecular Weight: | 413.58 |
| Molecular Formula: | C21 H19 N O2 S3 |
| Smiles: | CC1(C)C2=C(C(=S)SS2)c2cccc(c2N1C(Cc1ccccc1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.5271 |
| logD: | 4.5271 |
| logSw: | -4.7007 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 22.6946 |
| InChI Key: | LZCKLQXYXMLEHW-UHFFFAOYSA-N |