(E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide
TL;DR: (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide (CAS 876880-35-2) is a chemical compound with molecular formula C19H13N3O4 and molecular weight 347.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide
Also Known As: (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide, 2-cyano-N-(1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide
| Molecular Formula | C19H13N3O4 |
|---|---|
| Molecular Weight | 347.09 g/mol |
| LogP | 2.12448 |
| Topological Polar Surface Area | 108.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.0906 |
| Heavy Atoms | 26 |
| Complexity | 984.8341 |
Chemical Identifiers
| CAS Number | 876880-35-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=CC3=C2C(=O)NC3=O |
Product Overview
(E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide (CAS 876880-35-2), with molecular formula C19H13N3O4 and molecular weight 347.09 g/mol. IUPAC: (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide.
Chemical Property Profile of (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide
Property Insights of (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide
The XLogP value of 2.12448 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide. The TPSA of 108.29 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide. Following Lipinski's Rule of Five, (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide has 2 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 (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide?
The CAS number of (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide is 876880-35-2.
What is the molecular formula of (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide?
The molecular formula of (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide is C19H13N3O4.
What is the molecular weight of (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide?
The molecular weight of (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide is 347.09 g/mol.
Where can I buy (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide?
You can request a quote for (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-cyano-N-(1,3-dioxoisoindol-4-yl)-3-(4-methoxyphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.