2-[2-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl]hexahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[2-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl]hexahydro-1H-isoindole-1,3(2H)-dione
2-[2-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl]hexahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3389-1456 |
| Compound Name: | 2-[2-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl]hexahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 488.65 |
| Molecular Formula: | C23 H24 N2 O4 S3 |
| Smiles: | CC1(C)C2=C(C(=S)SS2)c2cc(ccc2N1C(CN1C(C2CCCCC2C1=O)=O)=O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2421 |
| logD: | 3.2421 |
| logSw: | -3.6251 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 51.167 |
| InChI Key: | YKIPQFCILRSDDN-UHFFFAOYSA-N |