tetramethyl 9'-ethoxy-5',5'-dimethyl-6'-(thiophene-2-carbonyl)-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-6'-(thiophene-2-carbonyl)-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
tetramethyl 9'-ethoxy-5',5'-dimethyl-6'-(thiophene-2-carbonyl)-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Compound characteristics
| Compound ID: | 4477-1077 |
| Compound Name: | tetramethyl 9'-ethoxy-5',5'-dimethyl-6'-(thiophene-2-carbonyl)-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate |
| Molecular Weight: | 703.83 |
| Molecular Formula: | C31 H29 N O10 S4 |
| Smiles: | CCOc1ccc2c(c1)C1=C(C(C)(C)N2C(c2cccs2)=O)SC(=C(C(=O)OC)C12SC(=C(C(=O)OC)S2)C(=O)OC)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 6.0308 |
| logD: | 6.0308 |
| logSw: | -5.5708 |
| Hydrogen bond acceptors count: | 18 |
| Polar surface area: | 107.192 |
| InChI Key: | XUJZOUZNVAAMGE-UHFFFAOYSA-N |