1-Methylhypoxanthine
TL;DR: 1-Methylhypoxanthine (CAS 1125-39-9) is a chemical compound with molecular formula C6H6N4O and molecular weight 150.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-7H-purin-6-one
Also Known As: 1-Methylhypoxanthine, 1-methyl-1H-purin-6(9H)-one, Hypoxanthine, 1-methyl-, 1-methyl-7H-purin-6-one, 1-Methylhypoxanthin
| Molecular Formula | C6H6N4O |
|---|---|
| Molecular Weight | 150.05 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 150.05415 |
| Heavy Atoms | 11 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 1125-39-9 |
|---|---|
| SMILES | CN1C=NC2=C(C1=O)NC=N2 |
| InChIKey | KIQMCGMHGVXDFW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methylhypoxanthine (CAS 1125-39-9), with molecular formula C6H6N4O and molecular weight 150.05 g/mol. IUPAC: 1-methyl-7H-purin-6-one.
Chemical Property Profile of 1-Methylhypoxanthine
Property Insights of 1-Methylhypoxanthine
The XLogP value of -0.3 indicates that 1-Methylhypoxanthine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methylhypoxanthine. Following Lipinski's Rule of Five, 1-Methylhypoxanthine has 1 hydrogen bond donor(s) and 3 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 1-Methylhypoxanthine?
The CAS number of 1-Methylhypoxanthine is 1125-39-9.
What is the molecular formula of 1-Methylhypoxanthine?
The molecular formula of 1-Methylhypoxanthine is C6H6N4O.
What is the molecular weight of 1-Methylhypoxanthine?
The molecular weight of 1-Methylhypoxanthine is 150.05 g/mol.
Where can I buy 1-Methylhypoxanthine?
You can request a quote for 1-Methylhypoxanthine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methylhypoxanthine?
Yes, KEHONG BIO provides custom synthesis services for 1-Methylhypoxanthine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.