N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide
TL;DR: N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide (CAS 1662710-29-3) is a chemical compound with molecular formula C14H12N4O5 and molecular weight 316.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(E)-2-(5-nitro-2,4-dioxo-1H-pyrimidin-6-yl)ethenyl]phenyl]acetamide
Also Known As: BAS 08180893, (E)-N-(4-(2-(5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)vinyl)phenyl)acetamide, N-[4-[(E)-2-(5-nitro-2,4-dioxo-1H-pyrimidin-6-yl)ethenyl]phenyl]acetamide, N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide, N-{4-[(E)-2-(5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)ethenyl]phenyl}acetamide
| Molecular Formula | C14H12N4O5 |
|---|---|
| Molecular Weight | 316.08 g/mol |
| LogP | 1.1002 |
| Topological Polar Surface Area | 137.96 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 316.08078 |
| Heavy Atoms | 23 |
| Complexity | 892.619 |
Chemical Identifiers
| CAS Number | 1662710-29-3 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)/C=C/C2=C(C(=O)NC(=O)N2)[N+](=O)[O-] |
Product Overview
N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide (CAS 1662710-29-3), with molecular formula C14H12N4O5 and molecular weight 316.08 g/mol. IUPAC: N-[4-[(E)-2-(5-nitro-2,4-dioxo-1H-pyrimidin-6-yl)ethenyl]phenyl]acetamide.
Chemical Property Profile of N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide
Property Insights of N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide
The XLogP value of 1.1002 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide. The TPSA of 137.96 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide. Following Lipinski's Rule of Five, N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide has 3 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 N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide?
The CAS number of N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide is 1662710-29-3.
What is the molecular formula of N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide?
The molecular formula of N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide is C14H12N4O5.
What is the molecular weight of N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide?
The molecular weight of N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide is 316.08 g/mol.
Where can I buy N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide?
You can request a quote for N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-{4-[(E)-2-(2,6-dihydroxy-5-nitropyrimidin-4-yl)ethenyl]phenyl}acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.