6-Azathymine
TL;DR: 6-Azathymine (CAS 932-53-6) is a chemical compound with molecular formula C4H5N3O2 and molecular weight 127.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-2H-1,2,4-triazine-3,5-dione
Also Known As: 6-Azathymine, Azathymine, 5-Methyl-6-azauracil, 6-Methyl-1,2,4-triazine-3,5(2H,4H)-dione, Azathymine, 6
| Molecular Formula | C4H5N3O2 |
|---|---|
| Molecular Weight | 127.04 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 70.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 127.03818 |
| Heavy Atoms | 9 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 932-53-6 |
|---|---|
| SMILES | CC1=NNC(=O)NC1=O |
| InChIKey | XZWMZFQOHTWGQE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Azathymine (CAS 932-53-6), with molecular formula C4H5N3O2 and molecular weight 127.04 g/mol. IUPAC: 6-methyl-2H-1,2,4-triazine-3,5-dione.
Chemical Property Profile of 6-Azathymine
Property Insights of 6-Azathymine
The XLogP value of -0.3 indicates that 6-Azathymine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Azathymine. Following Lipinski's Rule of Five, 6-Azathymine has 2 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 6-Azathymine?
The CAS number of 6-Azathymine is 932-53-6.
What is the molecular formula of 6-Azathymine?
The molecular formula of 6-Azathymine is C4H5N3O2.
What is the molecular weight of 6-Azathymine?
The molecular weight of 6-Azathymine is 127.04 g/mol.
Where can I buy 6-Azathymine?
You can request a quote for 6-Azathymine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Azathymine?
Yes, KEHONG BIO provides custom synthesis services for 6-Azathymine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.