TL;DR: 6H-p-Dithiino(2,3-c)pyrrole-5,7-dione, 2,3,5,7-tetrahydro-6-methyl- (CAS 34419-05-1) is a chemical compound with molecular formula C7H7NO2S2 and molecular weight 200.99182 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-methyl-2,3-dihydro-[1,4]dithiino[2,3-c]pyrrole-5,7-dione
Also Known As: 5,6-Dihydro-N-methyl-p-dithiin-2,3-dicarboximide, N-Methyl-3,6-dithia-3,4,5,6-tetrahydrophthalimide, p-Dithiin-2,3-dicarboximide, 5,6-dihydro-N-methyl-, 6H-p-DITHIINO(2,3-c)PYRROLE-5,7-DIONE, 2,3,5,7-TETRAHYDRO-6-METHYL-, 5H-1,4-Dithiino(2,3-c)pyrrole-5,7(6H)-dione, 2,3-dihydro-6-methyl-
| Molecular Formula | C7H7NO2S2 |
| Molecular Weight | 200.99182 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 88.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 200.99182 Da |
| Heavy Atoms | 12 |
| Complexity | 270.0 |
| SMILES | CN1C(=O)C2=C(C1=O)SCCS2 |
| InChIKey | INNXFNOPKIFUDJ-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6H-p-Dithiino(2,3-c)pyrrole-5,7-dione, 2,3,5,7-tetrahydro-6-methyl-. The TPSA of 88.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6H-p-Dithiino(2,3-c)pyrrole-5,7-dione, 2,3,5,7-tetrahydro-6-methyl-. Following Lipinski's Rule of Five, 6H-p-Dithiino(2,3-c)pyrrole-5,7-dione, 2,3,5,7-tetrahydro-6-methyl- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6H-p-Dithiino(2,3-c)pyrrole-5,7-dione, 2,3,5,7-tetrahydro-6-methyl- is 34419-05-1.
The molecular formula of 6H-p-Dithiino(2,3-c)pyrrole-5,7-dione, 2,3,5,7-tetrahydro-6-methyl- is C7H7NO2S2.
The molecular weight of 6H-p-Dithiino(2,3-c)pyrrole-5,7-dione, 2,3,5,7-tetrahydro-6-methyl- is 200.99182 g/mol.
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