(E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide
TL;DR: (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide (CAS 173075-23-5) is a chemical compound with molecular formula C10H8N2O4 and molecular weight 220.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide
Also Known As: (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide, 2-Cyano-3-(3,4,5-trihydroxyphenyl)acrylamide, 2-Cyano-3-(3,4,5-trihydroxy-phenyl)-acrylamide, 2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide, (E)-2-Cyano-3-(3,4,5-trihydroxyphenyl)propenamide
| Molecular Formula | C10H8N2O4 |
|---|---|
| Molecular Weight | 220.05 g/mol |
| LogP | 0.19568 |
| Topological Polar Surface Area | 127.57 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.0484 |
| Heavy Atoms | 16 |
| Complexity | 491.0357 |
Chemical Identifiers
| CAS Number | 173075-23-5 |
|---|---|
| SMILES | C1=C(C=C(C(=C1O)O)O)/C=C(\C#N)/C(=O)N |
Product Overview
(E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide (CAS 173075-23-5), with molecular formula C10H8N2O4 and molecular weight 220.05 g/mol. IUPAC: (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide.
Chemical Property Profile of (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide
Property Insights of (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide
The XLogP value of 0.19568 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide. The TPSA of 127.57 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide. Following Lipinski's Rule of Five, (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide has 4 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-3-(3,4,5-trihydroxyphenyl)prop-2-enamide?
The CAS number of (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide is 173075-23-5.
What is the molecular formula of (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide?
The molecular formula of (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide is C10H8N2O4.
What is the molecular weight of (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide?
The molecular weight of (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide is 220.05 g/mol.
Where can I buy (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide?
You can request a quote for (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)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-3-(3,4,5-trihydroxyphenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-cyano-3-(3,4,5-trihydroxyphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.