![2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone structure](/static/products/5879/5879-11-8.webp)
2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone
TL;DR: 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone (CAS 5879-11-8) is a chemical compound with molecular formula C12H8ClN3O4 and molecular weight 293.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-2-(4-chlorophenyl)ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one
Also Known As: 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone, AB00100128-01, 2-[(E)-2-(4-chlorophenyl)ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one, 2-[2-(4-chlorophenyl)ethenyl]-6-hydroxy-5-nitro-3H-pyrimidin-4-one, 2-[(E)-2-(4-Chlorophenyl)ethen-1-yl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
| Molecular Formula | C12H8ClN3O4 |
|---|---|
| Molecular Weight | 293.02 g/mol |
| LogP | 2.2075 |
| Topological Polar Surface Area | 109.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.02032 |
| Heavy Atoms | 20 |
| Complexity | 737.3579 |
Chemical Identifiers
| CAS Number | 5879-11-8 |
|---|---|
| SMILES | C1=CC(=CC=C1/C=C/C2=NC(=C(C(=O)N2)[N+](=O)[O-])O)Cl |
Product Overview
2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone (CAS 5879-11-8), with molecular formula C12H8ClN3O4 and molecular weight 293.02 g/mol. IUPAC: 2-[(E)-2-(4-chlorophenyl)ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one.
Chemical Property Profile of 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone
Property Insights of 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone
The XLogP value of 2.2075 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone. The TPSA of 109.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone. Following Lipinski's Rule of Five, 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone 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 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone?
The CAS number of 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone is 5879-11-8.
What is the molecular formula of 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone?
The molecular formula of 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone is C12H8ClN3O4.
What is the molecular weight of 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone?
The molecular weight of 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone is 293.02 g/mol.
Where can I buy 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone?
You can request a quote for 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(4-chlorophenyl)vinyl]-6-hydroxy-5-nitro-4(3H)-pyrimidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.