2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide
TL;DR: 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide (CAS 133550-35-3) is a chemical compound with molecular formula C16H12N2O3 and molecular weight 280.08478 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-cyano-3-(3,4-dihydroxyphenyl)-N-phenylprop-2-enamide
Also Known As: Tyrphostin B48, TyrphostinAG494, Tyrphostin AG 494, AG 494, N-Phenyl-alpha-cyano-3,4-dihydroxycinnamamide
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H12N2O3 |
| Molecular Weight | 280.08478 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 93.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.08478 Da |
| Heavy Atoms | 21 |
| Complexity | 446.0 |
| SMILES | C1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)O)O)C#N |
| InChIKey | HKHOVJYOELRGMV-UHFFFAOYSA-N |
Product Description
Applications: 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide is used in pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide (CAS 133550-35-3) is a pharmaceutical intermediate with the molecular formula C16H12N2O3 and a molecular weight of 280.08 g/mol. Synonyms include Tyrphostin B48 and TyrphostinAG494.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide
Property Insights of 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide. The TPSA of 93.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide. Following Lipinski's Rule of Five, 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide?
The CAS number of 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide is 133550-35-3.
What is the molecular formula of 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide?
The molecular formula of 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide is C16H12N2O3.
What is the molecular weight of 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide?
The molecular weight of 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide is 280.08478 g/mol.
What are the applications of 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide?
2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide is used in pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full...
Where can I buy 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide?
You can request a quote for 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide?
Yes, CoreyChem provides custom synthesis services for 2-cyano-3-(3,4-dihydroxyphenyl)-N-phenyl-2-propenamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.