6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one
TL;DR: 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one (CAS 42937-97-3) is a chemical compound with molecular formula C4H4N4O4 and molecular weight 172.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-1-hydroxy-5-nitropyrimidin-2-one
Also Known As: 6-amino-1-hydroxy-5-nitropyrimidin-2(1h)-one, 6-amino-1-hydroxy-5-nitropyrimidin-2-one, 6-amino-1-hydroxy-5-nitro-pyrimidin-2-one, 2(1H)-Pyrimidinone, 6-amino-1-hydroxy-5-nitro-, 6-amino-1-hydroxy-5-nitro-1H-pyrimidin-2-one
| Molecular Formula | C4H4N4O4 |
|---|---|
| Molecular Weight | 172.02 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 172.02325 |
| Heavy Atoms | 12 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 42937-97-3 |
|---|---|
| SMILES | C1=NC(=O)N(C(=C1[N+](=O)[O-])N)O |
| InChIKey | QVLQTFWEBUBJLM-UHFFFAOYSA-N |
Product Overview
6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one (CAS 42937-97-3), with molecular formula C4H4N4O4 and molecular weight 172.02 g/mol. IUPAC: 6-amino-1-hydroxy-5-nitropyrimidin-2-one.
Chemical Property Profile of 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one
Property Insights of 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one
The XLogP value of -0.9 indicates that 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one. Following Lipinski's Rule of Five, 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one has 2 hydrogen bond donor(s) and 5 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 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one?
The CAS number of 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one is 42937-97-3.
What is the molecular formula of 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one?
The molecular formula of 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one is C4H4N4O4.
What is the molecular weight of 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one?
The molecular weight of 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one is 172.02 g/mol.
Where can I buy 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one?
You can request a quote for 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Amino-1-hydroxy-5-nitropyrimidin-2(1h)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.