4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester)
TL;DR: 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester) (CAS 1603-02-7) is a chemical compound with molecular formula C4H7N5O4S and molecular weight 221.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5,6-triaminopyrimidin-4-yl) hydrogen sulfate
Also Known As: 2,5,6-triaminopyrimidin-4-yl hydrogen sulfate, 2,5,6-Triaminopyrimidin-4-ol sulphate, Folic Acid Impurity 23, (2,5,6-triaminopyrimidin-4-yl) hydrogen sulfate, 6-Hydroxy 2,4,5-Triaminopyrimidine Sulfate
| Molecular Formula | C4H7N5O4S |
|---|---|
| Molecular Weight | 221.02 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 176.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.02188 |
| Heavy Atoms | 14 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 1603-02-7 |
|---|---|
| SMILES | C1(=C(N=C(N=C1OS(=O)(=O)O)N)N)N |
| InChIKey | DJUGBKWOBAOTFA-UHFFFAOYSA-N |
Product Overview
4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester) (CAS 1603-02-7), with molecular formula C4H7N5O4S and molecular weight 221.02 g/mol. IUPAC: (2,5,6-triaminopyrimidin-4-yl) hydrogen sulfate.
Chemical Property Profile of 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester)
Property Insights of 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester)
The XLogP value of -1.8 indicates that 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 176.0 Ų indicates high polarity, suggesting 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester) has 4 hydrogen bond donor(s) and 9 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 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester)?
The CAS number of 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester) is 1603-02-7.
What is the molecular formula of 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester)?
The molecular formula of 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester) is C4H7N5O4S.
What is the molecular weight of 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester)?
The molecular weight of 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester) is 221.02 g/mol.
Where can I buy 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester)?
You can request a quote for 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester)?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyrimidinol, 2,5,6-triamino-, hydrogen sulfate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.