1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate
TL;DR: 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate (CAS 325765-48-8) is a chemical compound with molecular formula C20H16N2O5 and molecular weight 364.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[[(Z)-2-cyano-3-phenylprop-2-enoyl]amino]benzene-1,4-dicarboxylate
Also Known As: Dimethyl 2-[[(Z)-2-cyano-3-phenylprop-2-enoyl]amino]benzene-1,4-dicarboxylate, 1,4-dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate
| Molecular Formula | C20H16N2O5 |
|---|---|
| Molecular Weight | 364.11 g/mol |
| LogP | 2.80548 |
| Topological Polar Surface Area | 105.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 364.10593 |
| Heavy Atoms | 27 |
| Complexity | 942.5896 |
Chemical Identifiers
| CAS Number | 325765-48-8 |
|---|---|
| SMILES | COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)/C(=C\C2=CC=CC=C2)/C#N |
Product Overview
1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate (CAS 325765-48-8), with molecular formula C20H16N2O5 and molecular weight 364.11 g/mol. IUPAC: dimethyl 2-[[(Z)-2-cyano-3-phenylprop-2-enoyl]amino]benzene-1,4-dicarboxylate.
Chemical Property Profile of 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate
Property Insights of 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate
The XLogP value of 2.80548 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate. The TPSA of 105.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate. Following Lipinski's Rule of Five, 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate has 1 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 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate?
The CAS number of 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate is 325765-48-8.
What is the molecular formula of 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate?
The molecular formula of 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate is C20H16N2O5.
What is the molecular weight of 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate?
The molecular weight of 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate is 364.11 g/mol.
Where can I buy 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate?
You can request a quote for 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dimethyl 2-(2-cyano-3-phenylprop-2-enamido)benzene-1,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.