5-Nitrosouracil
TL;DR: 5-Nitrosouracil (CAS 501119-24-0) is a chemical compound with molecular formula C4H3N3O3 and molecular weight 141.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitroso-1H-pyrimidine-2,4-dione
Also Known As: 5-nitrosouracil, 5-nitrosopyrimidine-2,4-diol, 5-Nitroso-2,4-pyrimidinediol, 5-nitroso-1H-pyrimidine-2,4-dione, pyrimidine-2,4,5(3h)-trione-5-oxime
| Molecular Formula | C4H3N3O3 |
|---|---|
| Molecular Weight | 141.02 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 87.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 141.01744 |
| Heavy Atoms | 10 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 501119-24-0 |
|---|---|
| SMILES | C1=C(C(=O)NC(=O)N1)N=O |
| InChIKey | KTQDGYGLGKJZPZ-UHFFFAOYSA-N |
Product Overview
5-Nitrosouracil (CAS 501119-24-0), with molecular formula C4H3N3O3 and molecular weight 141.02 g/mol. IUPAC: 5-nitroso-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 5-Nitrosouracil
Property Insights of 5-Nitrosouracil
The XLogP value of -1.4 indicates that 5-Nitrosouracil is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 87.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Nitrosouracil. Following Lipinski's Rule of Five, 5-Nitrosouracil 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 5-Nitrosouracil?
The CAS number of 5-Nitrosouracil is 501119-24-0.
What is the molecular formula of 5-Nitrosouracil?
The molecular formula of 5-Nitrosouracil is C4H3N3O3.
What is the molecular weight of 5-Nitrosouracil?
The molecular weight of 5-Nitrosouracil is 141.02 g/mol.
Where can I buy 5-Nitrosouracil?
You can request a quote for 5-Nitrosouracil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Nitrosouracil?
Yes, KEHONG BIO provides custom synthesis services for 5-Nitrosouracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.