2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid
TL;DR: 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid (CAS 49699-53-8) is a chemical compound with molecular formula C6H5N5O2 and molecular weight 179.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-6-(hydroxyiminomethyl)-3-iminopyrazine-2-carbonitrile
Also Known As: 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid, 4-hydroxy-6-(hydroxyiminomethyl)-3-iminopyrazine-2-carbonitrile, 3-AMINO-6-(HYDROXYIMINO)METHYLPYRAZINE-2-CARBONITRILE 4-OXIDE, 4-Hydroxy-6-[(hydroxyimino)methyl]-3-imino-3,4-dihydropyrazine-2-carbonitrile
| Molecular Formula | C6H5N5O2 |
|---|---|
| Molecular Weight | 179.04 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 179.04433 |
| Heavy Atoms | 13 |
| Complexity | 372.0 |
Chemical Identifiers
| CAS Number | 49699-53-8 |
|---|---|
| SMILES | C1=C(N=C(C(=N)N1O)C#N)C=NO |
| InChIKey | BOANKHODYZEKRM-UHFFFAOYSA-N |
Product Overview
2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid (CAS 49699-53-8), with molecular formula C6H5N5O2 and molecular weight 179.04 g/mol. IUPAC: 4-hydroxy-6-(hydroxyiminomethyl)-3-iminopyrazine-2-carbonitrile.
Chemical Property Profile of 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid
Property Insights of 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid
The XLogP value of -0.9 indicates that 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid. Following Lipinski's Rule of Five, 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid has 3 hydrogen bond donor(s) and 6 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 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid?
The CAS number of 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid is 49699-53-8.
What is the molecular formula of 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid?
The molecular formula of 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid is C6H5N5O2.
What is the molecular weight of 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid?
The molecular weight of 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid is 179.04 g/mol.
Where can I buy 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid?
You can request a quote for 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-3-cyano-5-oximinomethylpyrazin-1-oxid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.