diethyl 6'-acetyl-9'-methoxy-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'-methoxy-5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate
diethyl 6'-acetyl-9'-methoxy-5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate
Compound characteristics
| Compound ID: | 4477-1011 |
| Compound Name: | diethyl 6'-acetyl-9'-methoxy-5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-3',4-dicarboxylate |
| Molecular Weight: | 533.68 |
| Molecular Formula: | C25 H27 N O6 S3 |
| Smiles: | CCOC(C1=CC2(C3=C(C(C)(C)N(C(C)=O)c4ccc(cc34)OC)S1)SC=C(C(=O)OCC)S2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2342 |
| logD: | 5.2342 |
| logSw: | -5.1383 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 64.146 |
| InChI Key: | GFQJEBLZVWZUDY-VWLOTQADSA-N |