Benadrostin
TL;DR: Benadrostin (CAS 117241-60-8) is a chemical compound with molecular formula C8H5NO4 and molecular weight 179.02185 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-hydroxy-1,3-benzoxazine-2,4-dione
Also Known As: Benadrostin, 8-hydroxy-1,3-benzoxazine-2,4-dione, 8-Hydroxy-2H-1,3-benzoxazine-2,4(3H)-dione, 8-hydroxy-2H-1,3-benzoxazine-2,4-dione, 2H-1,3-Benzoxazine-2,4(3H)-dione, 8-hydroxy-
Technical Specifications
| Molecular Formula | C8H5NO4 |
| Molecular Weight | 179.02185 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 179.02185 Da |
| Heavy Atoms | 13 |
| Complexity | 253.0 |
| SMILES | C1=CC2=C(C(=C1)O)OC(=O)NC2=O |
| InChIKey | BQIRLGRTNUTGAT-UHFFFAOYSA-N |
Chemical Property Profile of Benadrostin
Property Insights of Benadrostin
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benadrostin. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Benadrostin. Following Lipinski's Rule of Five, Benadrostin has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benadrostin?
The CAS number of Benadrostin is 117241-60-8.
What is the molecular formula of Benadrostin?
The molecular formula of Benadrostin is C8H5NO4.
What is the molecular weight of Benadrostin?
The molecular weight of Benadrostin is 179.02185 g/mol.
Where can I buy Benadrostin?
You can request a quote for Benadrostin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benadrostin?
Yes, CoreyChem provides custom synthesis services for Benadrostin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.