5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione
TL;DR: 5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 19144-58-2) is a chemical compound with molecular formula C9H5N3O6 and molecular weight 251.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(5-nitrofuran-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: BAS 01051715, 5-[(5-nitrofuran-2-yl)methylidene]-1,3-diazinane-2,4,6-trione, 5-(5-Nitro-furan-2-ylmethylene)-pyrimidine-2,4,6-trione, 5-[(5-NITRO-2-FURYL)METHYLENE]-2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, (5Z)-2,6-dihydroxy-5-[(5-nitrofuran-2-yl)methylidene]pyrimidin-4(5H)-one
| Molecular Formula | C9H5N3O6 |
|---|---|
| Molecular Weight | 251.02 g/mol |
| LogP | -0.0628 |
| Topological Polar Surface Area | 131.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.01784 |
| Heavy Atoms | 18 |
| Complexity | 577.1991 |
Chemical Identifiers
| CAS Number | 19144-58-2 |
|---|---|
| SMILES | C1=C(OC(=C1)[N+](=O)[O-])C=C2C(=O)NC(=O)NC2=O |
Product Overview
5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 19144-58-2), with molecular formula C9H5N3O6 and molecular weight 251.02 g/mol. IUPAC: 5-[(5-nitrofuran-2-yl)methylidene]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione
Property Insights of 5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione
The XLogP value of -0.0628 indicates that 5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 131.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione. Following Lipinski's Rule of Five, 5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione has 2 hydrogen bond donor(s) and 6 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-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione?
The CAS number of 5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione is 19144-58-2.
What is the molecular formula of 5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular formula of 5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione is C9H5N3O6.
What is the molecular weight of 5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular weight of 5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione is 251.02 g/mol.
Where can I buy 5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione?
You can request a quote for 5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(5-Nitro-2-furyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.