diethyl 6'-acetyl-9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate
Chemical Structure Depiction of
diethyl 6'-acetyl-9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate
diethyl 6'-acetyl-9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate
Compound characteristics
| Compound ID: | 3389-1392 |
| Compound Name: | diethyl 6'-acetyl-9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate |
| Molecular Weight: | 547.71 |
| Molecular Formula: | C26 H29 N O6 S3 |
| Smiles: | CCOC(C1=CC2(C3=C(C(C)(C)N(C(C)=O)c4ccc(cc34)OCC)S1)SC=C(C(=O)OCC)S2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6217 |
| logD: | 5.6217 |
| logSw: | -5.4982 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 63.725 |
| InChI Key: | KSNGVPJKGKBPSA-SANMLTNESA-N |