TL;DR: 9-sulfinyl-9H-thioxanthene 10-oxide (CAS 15848-12-1) is a chemical compound with molecular formula C13H8O2S2 and molecular weight 259.99658 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9-sulfinylthioxanthene 10-oxide
Also Known As: 9-sulfinylthioxanthene 10-oxide, 9-sulfinyl-9H-thioxanthene 10-oxide, AB-131/25126081
| Molecular Formula | C13H8O2S2 |
| Molecular Weight | 259.99658 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 54.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 259.99658 Da |
| Heavy Atoms | 17 |
| Complexity | 359.0 |
| SMILES | C1=CC=C2C(=C1)C(=S=O)C3=CC=CC=C3S2=O |
| InChIKey | XMEKQDKVCRTTTR-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-sulfinyl-9H-thioxanthene 10-oxide. With a topological polar surface area (TPSA) of 54.4 Ų, 9-sulfinyl-9H-thioxanthene 10-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-sulfinyl-9H-thioxanthene 10-oxide 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 9-sulfinyl-9H-thioxanthene 10-oxide is 15848-12-1.
The molecular formula of 9-sulfinyl-9H-thioxanthene 10-oxide is C13H8O2S2.
The molecular weight of 9-sulfinyl-9H-thioxanthene 10-oxide is 259.99658 g/mol.
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