![2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one structure](/static/products/708/708975-41-1.png)
2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
TL;DR: 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one (CAS 708975-41-1) is a chemical compound with molecular formula C14H13N3O4 and molecular weight 287.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-2-(4-ethylphenyl)ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one
Also Known As: (E)-2-(4-ethylstyryl)-6-hydroxy-5-nitropyrimidin-4(3H)-one, 2-[(1E)-2-(4-ethylphenyl)vinyl]-5-nitropyrimidine-4,6-diol, 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one, 2-[2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitro-3H-pyrimidin-4-one, 2-[(E)-2-(4-ethylphenyl)ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one
| Molecular Formula | C14H13N3O4 |
|---|---|
| Molecular Weight | 287.09 g/mol |
| LogP | 2.1165 |
| Topological Polar Surface Area | 109.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 287.0906 |
| Heavy Atoms | 21 |
| Complexity | 747.8047 |
Chemical Identifiers
| CAS Number | 708975-41-1 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)/C=C/C2=NC(=C(C(=O)N2)[N+](=O)[O-])O |
Product Overview
2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one (CAS 708975-41-1), with molecular formula C14H13N3O4 and molecular weight 287.09 g/mol. IUPAC: 2-[(E)-2-(4-ethylphenyl)ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one.
Chemical Property Profile of 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Property Insights of 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
The XLogP value of 2.1165 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one. The TPSA of 109.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one. Following Lipinski's Rule of Five, 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-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 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one?
The CAS number of 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one is 708975-41-1.
What is the molecular formula of 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one?
The molecular formula of 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one is C14H13N3O4.
What is the molecular weight of 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one?
The molecular weight of 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one is 287.09 g/mol.
Where can I buy 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one?
You can request a quote for 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[(E)-2-(4-ethylphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.