diethyl 5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate
Chemical Structure Depiction of
diethyl 5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate
diethyl 5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate
Compound characteristics
| Compound ID: | 4477-1009 |
| Compound Name: | diethyl 5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate |
| Molecular Weight: | 461.62 |
| Molecular Formula: | C22 H23 N O4 S3 |
| Smiles: | CCOC(C1=CC2(C3=C(C(C)(C)Nc4ccccc34)S1)SC=C(C(=O)OCC)S2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7571 |
| logD: | 5.7571 |
| logSw: | -5.5498 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.31 |
| InChI Key: | JTMIWUFMGPXKIN-QFIPXVFZSA-N |