tetramethyl 5',5',9'-trimethyl-6'-(phenylacetyl)-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Chemical Structure Depiction of
tetramethyl 5',5',9'-trimethyl-6'-(phenylacetyl)-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
tetramethyl 5',5',9'-trimethyl-6'-(phenylacetyl)-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Compound characteristics
| Compound ID: | 2932-0384 |
| Compound Name: | tetramethyl 5',5',9'-trimethyl-6'-(phenylacetyl)-5',6'-dihydrospiro[[1,3]dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate |
| Molecular Weight: | 681.8 |
| Molecular Formula: | C33 H31 N O9 S3 |
| Smiles: | Cc1ccc2c(c1)C1=C(C(C)(C)N2C(Cc2ccccc2)=O)SC(=C(C(=O)OC)C12SC(=C(C(=O)OC)S2)C(=O)OC)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 6.0708 |
| logD: | 6.0708 |
| logSw: | -5.5487 |
| Hydrogen bond acceptors count: | 17 |
| Polar surface area: | 98.523 |
| InChI Key: | ZNXMQEYRPHEVRV-UHFFFAOYSA-N |