嘧啶N-氧化物
TL;DR: 嘧啶N-氧化物 (CAS 17043-94-6) is a chemical compound with molecular formula C4H4N2O and molecular weight 96.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
嘧啶N-氧化物
1-oxidopyrimidin-1-ium
Also Known As: Pyrimidine N-oxide, Pyrimidine 1-oxide, Pyrimidine-1-oxide, 1-oxidopyrimidin-1-ium, Pyrimidinen-oxide
| Molecular Formula | C4H4N2O |
|---|---|
| Molecular Weight | 96.03 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 38.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 96.032364 |
| Heavy Atoms | 7 |
| Complexity | 57.0 |
Chemical Identifiers
| CAS Number | 17043-94-6 |
|---|---|
| SMILES | C1=CN=C[N+](=C1)[O-] |
| InChIKey | OQZGLXOADHKTDN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
嘧啶N-氧化物 (CAS 17043-94-6), with molecular formula C4H4N2O and molecular weight 96.03 g/mol. IUPAC: 1-oxidopyrimidin-1-ium.
Chemical Property Profile of 嘧啶N-氧化物
Property Insights of 嘧啶N-氧化物
The XLogP value of -0.8 indicates that 嘧啶N-氧化物 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, 嘧啶N-氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 嘧啶N-氧化物 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 嘧啶N-氧化物?
The CAS number of 嘧啶N-氧化物 is 17043-94-6.
What is the molecular formula of 嘧啶N-氧化物?
The molecular formula of 嘧啶N-氧化物 is C4H4N2O.
What is the molecular weight of 嘧啶N-氧化物?
The molecular weight of 嘧啶N-氧化物 is 96.03 g/mol.
Where can I buy 嘧啶N-氧化物?
You can request a quote for 嘧啶N-氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 嘧啶N-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 嘧啶N-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.