6-Amino-5-nitro-1,2-dihydropyrimidin-2-one
TL;DR: 6-Amino-5-nitro-1,2-dihydropyrimidin-2-one (CAS 69099-99-6) is a chemical compound with molecular formula C4H4N4O3 and molecular weight 156.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-5-nitro-1H-pyrimidin-2-one
Also Known As: 5-Nitrocytosine, 5-nitro cytosine, 6-amino-5-nitro-1H-pyrimidin-2-one, 6-Amino-5-nitropyrimidin-2(1H)-one, 4-amino-5-nitro-1,2-dihydropyrimidin-2-one
| Molecular Formula | C4H4N4O3 |
|---|---|
| Molecular Weight | 156.03 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 156.02834 |
| Heavy Atoms | 11 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 69099-99-6 |
|---|---|
| SMILES | C1=NC(=O)NC(=C1[N+](=O)[O-])N |
| InChIKey | SPDBZGFVYQCVIU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Amino-5-nitro-1,2-dihydropyrimidin-2-one (CAS 69099-99-6), with molecular formula C4H4N4O3 and molecular weight 156.03 g/mol. IUPAC: 6-amino-5-nitro-1H-pyrimidin-2-one.
Chemical Property Profile of 6-Amino-5-nitro-1,2-dihydropyrimidin-2-one
Property Insights of 6-Amino-5-nitro-1,2-dihydropyrimidin-2-one
The XLogP value of -0.6 indicates that 6-Amino-5-nitro-1,2-dihydropyrimidin-2-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Amino-5-nitro-1,2-dihydropyrimidin-2-one. Following Lipinski's Rule of Five, 6-Amino-5-nitro-1,2-dihydropyrimidin-2-one has 2 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 6-Amino-5-nitro-1,2-dihydropyrimidin-2-one?
The CAS number of 6-Amino-5-nitro-1,2-dihydropyrimidin-2-one is 69099-99-6.
What is the molecular formula of 6-Amino-5-nitro-1,2-dihydropyrimidin-2-one?
The molecular formula of 6-Amino-5-nitro-1,2-dihydropyrimidin-2-one is C4H4N4O3.
What is the molecular weight of 6-Amino-5-nitro-1,2-dihydropyrimidin-2-one?
The molecular weight of 6-Amino-5-nitro-1,2-dihydropyrimidin-2-one is 156.03 g/mol.
Where can I buy 6-Amino-5-nitro-1,2-dihydropyrimidin-2-one?
You can request a quote for 6-Amino-5-nitro-1,2-dihydropyrimidin-2-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-5-nitro-1,2-dihydropyrimidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Amino-5-nitro-1,2-dihydropyrimidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.