2-[1-oxo-3-phenyl-1-(4,4,8-trimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)propan-2-yl]-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[1-oxo-3-phenyl-1-(4,4,8-trimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)propan-2-yl]-1H-isoindole-1,3(2H)-dione
2-[1-oxo-3-phenyl-1-(4,4,8-trimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)propan-2-yl]-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3389-1265 |
| Compound Name: | 2-[1-oxo-3-phenyl-1-(4,4,8-trimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)propan-2-yl]-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 556.72 |
| Molecular Formula: | C30 H24 N2 O3 S3 |
| Smiles: | Cc1ccc2c(c1)C1=C(C(C)(C)N2C(C(Cc2ccccc2)N2C(c3ccccc3C2=O)=O)=O)SSC1=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4549 |
| logD: | 6.4549 |
| logSw: | -5.7581 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 42.613 |
| InChI Key: | OJFXJSFYYHLXEG-QHCPKHFHSA-N |