dimethyl 2-(4,4,8,9-tetramethyl-1,2-dioxo-5-sulfanylidene-1,2,4,5-tetrahydro-6H-pyrrolo[3,2,1-ij]quinolin-6-ylidene)-2H-1,3-dithiole-4,5-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-(4,4,8,9-tetramethyl-1,2-dioxo-5-sulfanylidene-1,2,4,5-tetrahydro-6H-pyrrolo[3,2,1-ij]quinolin-6-ylidene)-2H-1,3-dithiole-4,5-dicarboxylate
dimethyl 2-(4,4,8,9-tetramethyl-1,2-dioxo-5-sulfanylidene-1,2,4,5-tetrahydro-6H-pyrrolo[3,2,1-ij]quinolin-6-ylidene)-2H-1,3-dithiole-4,5-dicarboxylate
Compound characteristics
| Compound ID: | 5402-0409 |
| Compound Name: | dimethyl 2-(4,4,8,9-tetramethyl-1,2-dioxo-5-sulfanylidene-1,2,4,5-tetrahydro-6H-pyrrolo[3,2,1-ij]quinolin-6-ylidene)-2H-1,3-dithiole-4,5-dicarboxylate |
| Molecular Weight: | 489.59 |
| Molecular Formula: | C22 H19 N O6 S3 |
| Smiles: | Cc1cc2C(=C3SC(=C(C(=O)OC)S3)C(=O)OC)C(C(C)(C)N3C(C(c(c1C)c23)=O)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 4.2775 |
| logD: | 4.2775 |
| logSw: | -4.5556 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 72.297 |
| InChI Key: | QAGJBLUDFXOSBH-UHFFFAOYSA-N |