5-Hydroxyisoquinoline-1-carboxylic acid
TL;DR: 5-Hydroxyisoquinoline-1-carboxylic acid (CAS 916-94-9) is a chemical compound with molecular formula C10H7NO3 and molecular weight 189.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxyisoquinoline-1-carboxylic acid
Also Known As: 5-hydroxyisoquinoline-1-carboxylic acid, 1-Isoquinolinecarboxylicacid, 5-hydroxy-, 1-Isoquinolinecarboxylic acid, 5-hydroxy-, 5-hydroxy-isoquinoline-1-carboxylic acid
| Molecular Formula | C10H7NO3 |
|---|---|
| Molecular Weight | 189.04 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 70.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.04259 |
| Heavy Atoms | 14 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 916-94-9 |
|---|---|
| SMILES | C1=CC2=C(C=CN=C2C(=O)O)C(=C1)O |
| InChIKey | GYWACVVCOABXJM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Hydroxyisoquinoline-1-carboxylic acid (CAS 916-94-9), with molecular formula C10H7NO3 and molecular weight 189.04 g/mol. IUPAC: 5-hydroxyisoquinoline-1-carboxylic acid.
Chemical Property Profile of 5-Hydroxyisoquinoline-1-carboxylic acid
Property Insights of 5-Hydroxyisoquinoline-1-carboxylic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Hydroxyisoquinoline-1-carboxylic acid. The TPSA of 70.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Hydroxyisoquinoline-1-carboxylic acid. Following Lipinski's Rule of Five, 5-Hydroxyisoquinoline-1-carboxylic acid 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 5-Hydroxyisoquinoline-1-carboxylic acid?
The CAS number of 5-Hydroxyisoquinoline-1-carboxylic acid is 916-94-9.
What is the molecular formula of 5-Hydroxyisoquinoline-1-carboxylic acid?
The molecular formula of 5-Hydroxyisoquinoline-1-carboxylic acid is C10H7NO3.
What is the molecular weight of 5-Hydroxyisoquinoline-1-carboxylic acid?
The molecular weight of 5-Hydroxyisoquinoline-1-carboxylic acid is 189.04 g/mol.
Where can I buy 5-Hydroxyisoquinoline-1-carboxylic acid?
You can request a quote for 5-Hydroxyisoquinoline-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Hydroxyisoquinoline-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Hydroxyisoquinoline-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.