tetramethyl 9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Chemical Structure Depiction of
tetramethyl 9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
tetramethyl 9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Compound characteristics
| Compound ID: | 3389-0620 |
| Compound Name: | tetramethyl 9'-ethoxy-5',5'-dimethyl-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate |
| Molecular Weight: | 593.69 |
| Molecular Formula: | C26 H27 N O9 S3 |
| Smiles: | CCOc1ccc2c(c1)C1=C(C(C)(C)N2)SC(=C(C(=O)OC)C12SC(=C(C(=O)OC)S2)C(=O)OC)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.2609 |
| logD: | 5.2609 |
| logSw: | -5.0888 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.622 |
| InChI Key: | JYBDTMJCZXDIGW-UHFFFAOYSA-N |