TL;DR: Sulbenox (CAS 58095-31-1) is a chemical compound with molecular formula C9H10N2O2S and molecular weight 210.0463 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(7-oxo-5,6-dihydro-4H-1-benzothiophen-4-yl)urea
Also Known As: Sulbenox, Sulbenoxum, Vigazoo, Sulbenox [USAN:INN], Sulbenoxum [INN-Latin]
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H10N2O2S |
| Molecular Weight | 210.0463 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.0463 Da |
| Heavy Atoms | 14 |
| Complexity | 270.0 |
| SMILES | C1CC(=O)C2=C(C1NC(=O)N)C=CS2 |
| InChIKey | KNKOUDKOHSNMEL-UHFFFAOYSA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sulbenox. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sulbenox. Following Lipinski's Rule of Five, Sulbenox has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Sulbenox is 58095-31-1.
The molecular formula of Sulbenox is C9H10N2O2S.
The molecular weight of Sulbenox is 210.0463 g/mol.
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