Oxalinast
TL;DR: Oxalinast (CAS 90390-16-2) is a chemical compound with molecular formula C14H13NO4 and molecular weight 259.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-oxo-2-[(2-oxo-6,7,8,8a-tetrahydro-1H-acenaphthylen-3-yl)amino]acetic acid
Also Known As: Oxalinast, Oxalinastum, Oxalinast [INN], DL-Carnitineorotate, (+-)-(6,7,8,8a-Tetrahydro-2-oxo-3-acenaphthenyl)oxamic acid
| Molecular Formula | C14H13NO4 |
|---|---|
| Molecular Weight | 259.08 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 83.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.08447 |
| Heavy Atoms | 19 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 90390-16-2 |
|---|---|
| SMILES | C1CC2CC(=O)C3=C(C=CC(=C23)C1)NC(=O)C(=O)O |
| InChIKey | DHMOBVVEHRKNIO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Oxalinast (CAS 90390-16-2), with molecular formula C14H13NO4 and molecular weight 259.08 g/mol. IUPAC: 2-oxo-2-[(2-oxo-6,7,8,8a-tetrahydro-1H-acenaphthylen-3-yl)amino]acetic acid.
Chemical Property Profile of Oxalinast
Property Insights of Oxalinast
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxalinast. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Oxalinast. Following Lipinski's Rule of Five, Oxalinast 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
Frequently Asked Questions
What is the CAS number of Oxalinast?
The CAS number of Oxalinast is 90390-16-2.
What is the molecular formula of Oxalinast?
The molecular formula of Oxalinast is C14H13NO4.
What is the molecular weight of Oxalinast?
The molecular weight of Oxalinast is 259.08 g/mol.
Where can I buy Oxalinast?
You can request a quote for Oxalinast directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxalinast?
Yes, KEHONG BIO provides custom synthesis services for Oxalinast and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.