(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)(3-nitrophenyl)methanone
Chemical Structure Depiction of
(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)(3-nitrophenyl)methanone
(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)(3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | 3389-0628 |
| Compound Name: | (8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)(3-nitrophenyl)methanone |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C20 H16 N2 O4 S3 |
| Smiles: | CC1(C)C2=C(C(=S)SS2)c2cc(ccc2N1C(c1cccc(c1)[N+]([O-])=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.5296 |
| logD: | 4.5296 |
| logSw: | -4.5566 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 55.36 |
| InChI Key: | QQPANFYNZJYNHO-UHFFFAOYSA-N |