![[4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate structure](/static/products/1164/1164533-12-3.webp)
[4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate
TL;DR: [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate (CAS 1164533-12-3) is a chemical compound with molecular formula C17H12N2O4 and molecular weight 308.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate
Also Known As: [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate|picolinic acid [4-[(E)-2-cyano-3-keto-3-methoxy-prop-1-enyl]phenyl] ester|[4-[(E)-2-cyano-3-methoxy-3-oxidanylidene-prop-1-enyl]phenyl] pyridine-2-carboxylate|2-pyridinecarboxylic acid [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] ester|4-[(1E)-2-Cyano-3-methoxy-3-oxo-1-propen-1-yl]phenyl 2-pyridinecarboxylate|4-[(1E)-2-Cyano-3-methoxy-3-oxoprop-1-en-1-yl]phenyl pyridine-2-carboxylate|MLS000375018|SMR000254371|cid_2312307
| Molecular Formula | C17H12N2O4 |
|---|---|
| Molecular Weight | 308.08 g/mol |
| LogP | 2.38078 |
| Topological Polar Surface Area | 89.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.0797 |
| Heavy Atoms | 23 |
| Complexity | 774.4907 |
Chemical Identifiers
| CAS Number | 1164533-12-3 |
|---|---|
| SMILES | COC(=O)/C(=C/C1=CC=C(C=C1)OC(=O)C2=CC=CC=N2)/C#N |
Product Overview
[4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate (CAS 1164533-12-3), with molecular formula C17H12N2O4 and molecular weight 308.08 g/mol. IUPAC: [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate.
Chemical Property Profile of [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate
Property Insights of [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate
The XLogP value of 2.38078 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate. The TPSA of 89.28 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate. Following Lipinski's Rule of Five, [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate has 0 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 [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate?
The CAS number of [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate is 1164533-12-3.
What is the molecular formula of [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate?
The molecular formula of [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate is C17H12N2O4.
What is the molecular weight of [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate?
The molecular weight of [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate is 308.08 g/mol.
Where can I buy [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate?
You can request a quote for [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [4-[(E)-2-cyano-3-methoxy-3-oxoprop-1-enyl]phenyl] pyridine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.