5-Methyl-1-oxidopyrimidin-1-ium
TL;DR: 5-Methyl-1-oxidopyrimidin-1-ium (CAS 17758-50-8) is a chemical compound with molecular formula C5H6N2O and molecular weight 110.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-1-oxidopyrimidin-1-ium
Also Known As: 5-Methylpyrimidine 1-oxide, 5-methyl-pyrimidine 1-oxide, 5-methyl-1-oxidopyrimidin-1-ium, Pyrimidine, 5-methyl-, 1-oxide, 5-METHYLPYRIMIDIN-1-IUM-1-OLATE
| Molecular Formula | C5H6N2O |
|---|---|
| Molecular Weight | 110.05 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 38.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 110.04801 |
| Heavy Atoms | 8 |
| Complexity | 76.0 |
Chemical Identifiers
| CAS Number | 17758-50-8 |
|---|---|
| SMILES | CC1=CN=C[N+](=C1)[O-] |
| InChIKey | LGZOHWUBLSMKAX-UHFFFAOYSA-N |
Product Overview
5-Methyl-1-oxidopyrimidin-1-ium (CAS 17758-50-8), with molecular formula C5H6N2O and molecular weight 110.05 g/mol. IUPAC: 5-methyl-1-oxidopyrimidin-1-ium.
Chemical Property Profile of 5-Methyl-1-oxidopyrimidin-1-ium
Property Insights of 5-Methyl-1-oxidopyrimidin-1-ium
The XLogP value of -0.4 indicates that 5-Methyl-1-oxidopyrimidin-1-ium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 38.4 Ų, 5-Methyl-1-oxidopyrimidin-1-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-1-oxidopyrimidin-1-ium has 0 hydrogen bond donor(s) and 2 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-Methyl-1-oxidopyrimidin-1-ium?
The CAS number of 5-Methyl-1-oxidopyrimidin-1-ium is 17758-50-8.
What is the molecular formula of 5-Methyl-1-oxidopyrimidin-1-ium?
The molecular formula of 5-Methyl-1-oxidopyrimidin-1-ium is C5H6N2O.
What is the molecular weight of 5-Methyl-1-oxidopyrimidin-1-ium?
The molecular weight of 5-Methyl-1-oxidopyrimidin-1-ium is 110.05 g/mol.
Where can I buy 5-Methyl-1-oxidopyrimidin-1-ium?
You can request a quote for 5-Methyl-1-oxidopyrimidin-1-ium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-1-oxidopyrimidin-1-ium?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-1-oxidopyrimidin-1-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.