5-Amino-4,6-dihydroxypyrimidine
TL;DR: 5-Amino-4,6-dihydroxypyrimidine (CAS 6947-82-6) is a chemical compound with molecular formula C4H5N3O2 and molecular weight 127.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-4-hydroxy-1H-pyrimidin-6-one
Also Known As: 5-Amino-4,6-dihydroxypyrimidine, 5-aminopyrimidine-4,6-diol, Nc1c(O)ncnc1O, quinoline-2,8-diol, 5-amino-4-hydroxy-1H-pyrimidin-6-one
| Molecular Formula | C4H5N3O2 |
|---|---|
| Molecular Weight | 127.04 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 127.03818 |
| Heavy Atoms | 9 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 6947-82-6 |
|---|---|
| SMILES | C1=NC(=C(C(=O)N1)N)O |
| InChIKey | YKHPWCZPESTMRF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Amino-4,6-dihydroxypyrimidine (CAS 6947-82-6), with molecular formula C4H5N3O2 and molecular weight 127.04 g/mol. IUPAC: 5-amino-4-hydroxy-1H-pyrimidin-6-one.
Chemical Property Profile of 5-Amino-4,6-dihydroxypyrimidine
Property Insights of 5-Amino-4,6-dihydroxypyrimidine
The XLogP value of -1.3 indicates that 5-Amino-4,6-dihydroxypyrimidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-4,6-dihydroxypyrimidine. Following Lipinski's Rule of Five, 5-Amino-4,6-dihydroxypyrimidine has 3 hydrogen bond donor(s) and 4 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-Amino-4,6-dihydroxypyrimidine?
The CAS number of 5-Amino-4,6-dihydroxypyrimidine is 6947-82-6.
What is the molecular formula of 5-Amino-4,6-dihydroxypyrimidine?
The molecular formula of 5-Amino-4,6-dihydroxypyrimidine is C4H5N3O2.
What is the molecular weight of 5-Amino-4,6-dihydroxypyrimidine?
The molecular weight of 5-Amino-4,6-dihydroxypyrimidine is 127.04 g/mol.
Where can I buy 5-Amino-4,6-dihydroxypyrimidine?
You can request a quote for 5-Amino-4,6-dihydroxypyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-4,6-dihydroxypyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-4,6-dihydroxypyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.