N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide
TL;DR: N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide (CAS 133550-30-8) is a chemical compound with molecular formula C17H14N2O3 and molecular weight 294.10043 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide
Also Known As: Tyrphostin B42, Tyrphostin AG 490, Tyrphostin B 42, KBio2_000116, KBio2_002684
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H14N2O3 |
| Molecular Weight | 294.10043 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 93.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.10043 Da |
| Heavy Atoms | 22 |
| Complexity | 460.0 |
| SMILES | C1=CC=C(C=C1)CNC(=O)C(=CC2=CC(=C(C=C2)O)O)C#N |
| InChIKey | TUCIOBMMDDOEMM-UHFFFAOYSA-N |
Product Description
Applications: N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide is used in pharmaceutical synthesis routes and API production, as well as analytical chemistry as a reagent, standard, or reference material. 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).
A pharmaceutical intermediate supplied by CoreyChem, N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide (CAS 133550-30-8) has the molecular formula C17H14N2O3 and a molecular weight of 294.1 g/mol. Synonyms include Tyrphostin B42 and Tyrphostin AG 490.
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 N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide
Property Insights of N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide. The TPSA of 93.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide. Following Lipinski's Rule of Five, N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide 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 N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide?
The CAS number of N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide is 133550-30-8.
What is the molecular formula of N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide?
The molecular formula of N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide is C17H14N2O3.
What is the molecular weight of N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide?
The molecular weight of N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide is 294.10043 g/mol.
What are the applications of N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide?
N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide is used in pharmaceutical synthesis routes and API production, as well as analytical chemistry as a reagent, standard, or reference material. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as...
Where can I buy N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide?
You can request a quote for N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide?
Yes, CoreyChem provides custom synthesis services for N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.