ethyl {5-[6-(4-chlorophenyl)-4,4,6,8-tetramethyl-2-oxo-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1(2H)-ylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}acetate
Chemical Structure Depiction of
ethyl {5-[6-(4-chlorophenyl)-4,4,6,8-tetramethyl-2-oxo-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1(2H)-ylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}acetate
ethyl {5-[6-(4-chlorophenyl)-4,4,6,8-tetramethyl-2-oxo-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1(2H)-ylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}acetate
Compound characteristics
| Compound ID: | Y021-3539 |
| Compound Name: | ethyl {5-[6-(4-chlorophenyl)-4,4,6,8-tetramethyl-2-oxo-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1(2H)-ylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}acetate |
| Molecular Weight: | 539.05 |
| Molecular Formula: | C28 H27 Cl N2 O5 S |
| Smiles: | CCOC(CN1C(/C(=C2C(N3c4c\2cc(C)cc4C(C)(CC3(C)C)c2ccc(cc2)[Cl])=O)SC1=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.332 |
| logD: | 5.332 |
| logSw: | -5.7504 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 66.209 |
| InChI Key: | QXCHHPWSEGXHDL-NDEPHWFRSA-N |