TL;DR: 6-Aminosaccharin (CAS 22094-62-8) is a chemical compound with molecular formula C7H6N2O3S and molecular weight 198.00992 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-amino-1,1-dioxo-1,2-benzothiazol-3-one
Also Known As: 6-Aminosaccharin, 6-amino-1,1-dioxo-1,2-benzothiazol-3-one, 6-amino-saccharin, 4cq0, 6-amino-2,3-dihydro-1
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H6N2O3S |
| Molecular Weight | 198.00992 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 97.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 198.00992 Da |
| Heavy Atoms | 13 |
| Complexity | 332.0 |
| SMILES | C1=CC2=C(C=C1N)S(=O)(=O)NC2=O |
| InChIKey | SSRKZHLPNHLAKM-UHFFFAOYSA-N |
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Aminosaccharin. The TPSA of 97.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Aminosaccharin. Following Lipinski's Rule of Five, 6-Aminosaccharin has 2 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 6-Aminosaccharin is 22094-62-8.
The molecular formula of 6-Aminosaccharin is C7H6N2O3S.
The molecular weight of 6-Aminosaccharin is 198.00992 g/mol.
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