(3-fluorophenyl)(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
(3-fluorophenyl)(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)methanone
(3-fluorophenyl)(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: | Y021-0010 |
| Compound Name: | (3-fluorophenyl)(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)methanone |
| Molecular Weight: | 417.54 |
| Molecular Formula: | C20 H16 F N O2 S3 |
| Smiles: | CC1(C)C2=C(C(=S)SS2)c2cc(ccc2N1C(c1cccc(c1)F)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.7064 |
| logD: | 4.7064 |
| logSw: | -4.6683 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 21.9781 |
| InChI Key: | PCXYDKQVNCNKHS-UHFFFAOYSA-N |