![ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate structure](/static/products/3260/326020-32-0.webp)
ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate
TL;DR: ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate (CAS 326020-32-0) is a chemical compound with molecular formula C16H12N2O4 and molecular weight 296.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (Z)-2-cyano-3-[4-(2,5-dioxopyrrol-1-yl)phenyl]prop-2-enoate
Also Known As: Ethyl (Z)-2-cyano-3-[4-(2,5-dioxopyrrol-1-yl)phenyl]prop-2-enoate, ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate
| Molecular Formula | C16H12N2O4 |
|---|---|
| Molecular Weight | 296.08 g/mol |
| LogP | 1.58608 |
| Topological Polar Surface Area | 87.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.0797 |
| Heavy Atoms | 22 |
| Complexity | 705.5079 |
Chemical Identifiers
| CAS Number | 326020-32-0 |
|---|---|
| SMILES | CCOC(=O)/C(=C\C1=CC=C(C=C1)N2C(=O)C=CC2=O)/C#N |
Product Overview
ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate (CAS 326020-32-0), with molecular formula C16H12N2O4 and molecular weight 296.08 g/mol. IUPAC: ethyl (Z)-2-cyano-3-[4-(2,5-dioxopyrrol-1-yl)phenyl]prop-2-enoate.
Chemical Property Profile of ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate
Property Insights of ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate
The XLogP value of 1.58608 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate. The TPSA of 87.47 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate. Following Lipinski's Rule of Five, ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate has 0 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 ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate?
The CAS number of ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate is 326020-32-0.
What is the molecular formula of ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate?
The molecular formula of ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate is C16H12N2O4.
What is the molecular weight of ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate?
The molecular weight of ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate is 296.08 g/mol.
Where can I buy ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate?
You can request a quote for ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-cyano-3-[4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)phenyl]prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.