4,6-Diamino-5-pyrimidinyl hydrogensulfate
TL;DR: 4,6-Diamino-5-pyrimidinyl hydrogensulfate (CAS 71525-41-2) is a chemical compound with molecular formula C4H6N4O4S and molecular weight 206.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4,6-diaminopyrimidin-5-yl) hydrogen sulfate
Also Known As: 4,6-Diamino-5-pyrimidinyl hydrogensulfate, 4,6-Diaminopyrimidin-5-yl hydrogen sulfate, (4,6-diaminopyrimidin-5-yl) hydrogen sulfate
| Molecular Formula | C4H6N4O4S |
|---|---|
| Molecular Weight | 206.01 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.01097 |
| Heavy Atoms | 13 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 71525-41-2 |
|---|---|
| SMILES | C1=NC(=C(C(=N1)N)OS(=O)(=O)O)N |
| InChIKey | VNWIZGVHRMCFTD-UHFFFAOYSA-N |
Product Overview
4,6-Diamino-5-pyrimidinyl hydrogensulfate (CAS 71525-41-2), with molecular formula C4H6N4O4S and molecular weight 206.01 g/mol. IUPAC: (4,6-diaminopyrimidin-5-yl) hydrogen sulfate.
Chemical Property Profile of 4,6-Diamino-5-pyrimidinyl hydrogensulfate
Property Insights of 4,6-Diamino-5-pyrimidinyl hydrogensulfate
The XLogP value of -1.4 indicates that 4,6-Diamino-5-pyrimidinyl hydrogensulfate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 150.0 Ų indicates high polarity, suggesting 4,6-Diamino-5-pyrimidinyl hydrogensulfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4,6-Diamino-5-pyrimidinyl hydrogensulfate has 3 hydrogen bond donor(s) and 8 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 4,6-Diamino-5-pyrimidinyl hydrogensulfate?
The CAS number of 4,6-Diamino-5-pyrimidinyl hydrogensulfate is 71525-41-2.
What is the molecular formula of 4,6-Diamino-5-pyrimidinyl hydrogensulfate?
The molecular formula of 4,6-Diamino-5-pyrimidinyl hydrogensulfate is C4H6N4O4S.
What is the molecular weight of 4,6-Diamino-5-pyrimidinyl hydrogensulfate?
The molecular weight of 4,6-Diamino-5-pyrimidinyl hydrogensulfate is 206.01 g/mol.
Where can I buy 4,6-Diamino-5-pyrimidinyl hydrogensulfate?
You can request a quote for 4,6-Diamino-5-pyrimidinyl hydrogensulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Diamino-5-pyrimidinyl hydrogensulfate?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Diamino-5-pyrimidinyl hydrogensulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.