Benaxibine
TL;DR: Benaxibine (CAS 27661-27-4) is a chemical compound with molecular formula C12H15NO6 and molecular weight 269.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]amino]benzoic acid
Also Known As: Benaxibine, Benaxibina, Benaxibinum, Chevalizon, Benaxibine [INN]
| Molecular Formula | C12H15NO6 |
|---|---|
| Molecular Weight | 269.09 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.08994 |
| Heavy Atoms | 19 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 27661-27-4 |
|---|---|
| SMILES | C1[C@H]([C@@H]([C@H](C(O1)NC2=CC=C(C=C2)C(=O)O)O)O)O |
| InChIKey | HLDUHCYBUVVDOT-GZBOUJLJSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benaxibine (CAS 27661-27-4), with molecular formula C12H15NO6 and molecular weight 269.09 g/mol. IUPAC: 4-[[(3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]amino]benzoic acid.
Chemical Property Profile of Benaxibine
Property Insights of Benaxibine
The XLogP value of -0.6 indicates that Benaxibine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benaxibine. Following Lipinski's Rule of Five, Benaxibine has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benaxibine?
The CAS number of Benaxibine is 27661-27-4.
What is the molecular formula of Benaxibine?
The molecular formula of Benaxibine is C12H15NO6.
What is the molecular weight of Benaxibine?
The molecular weight of Benaxibine is 269.09 g/mol.
Where can I buy Benaxibine?
You can request a quote for Benaxibine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benaxibine?
Yes, KEHONG BIO provides custom synthesis services for Benaxibine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.