![2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol structure](/static/products/797/797778-72-4.png)
2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol
TL;DR: 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol (CAS 797778-72-4) is a chemical compound with molecular formula C16H9Cl2N3O5 and molecular weight 392.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one
Also Known As: BAS 08853305, (E)-2-(2-(5-(2,3-dichlorophenyl)furan-2-yl)vinyl)-6-hydroxy-5-nitropyrimidin-4(3H)-one, 2-[(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one, 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol
| Molecular Formula | C16H9Cl2N3O5 |
|---|---|
| Molecular Weight | 392.99 g/mol |
| LogP | 4.1209 |
| Topological Polar Surface Area | 122.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 392.9919 |
| Heavy Atoms | 26 |
| Complexity | 1087.7295 |
Chemical Identifiers
| CAS Number | 797778-72-4 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)Cl)C2=CC=C(O2)/C=C/C3=NC(=C(C(=O)N3)[N+](=O)[O-])O |
Product Overview
2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol (CAS 797778-72-4), with molecular formula C16H9Cl2N3O5 and molecular weight 392.99 g/mol. IUPAC: 2-[(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl]-4-hydroxy-5-nitro-1H-pyrimidin-6-one.
Chemical Property Profile of 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol
Property Insights of 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol
The XLogP value of 4.1209 indicates that 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol. Following Lipinski's Rule of Five, 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol 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 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol?
The CAS number of 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol is 797778-72-4.
What is the molecular formula of 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol?
The molecular formula of 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol is C16H9Cl2N3O5.
What is the molecular weight of 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol?
The molecular weight of 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol is 392.99 g/mol.
Where can I buy 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol?
You can request a quote for 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol 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-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol?
Yes, KEHONG BIO provides custom synthesis services for 2-{(E)-2-[5-(2,3-dichlorophenyl)furan-2-yl]ethenyl}-5-nitropyrimidine-4,6-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.