(E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide
TL;DR: (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide (CAS 1110820-58-0) is a chemical compound with molecular formula C20H18N2O4 and molecular weight 350.12665 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide
Also Known As: (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide, N-benzyl-2-cyano-3-(8-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enamide
Technical Specifications
| Molecular Formula | C20H18N2O4 |
| Molecular Weight | 350.12665 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 80.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.12665 Da |
| Heavy Atoms | 26 |
| Complexity | 561.0 |
| SMILES | COC1=CC(=CC2=C1OCCO2)/C=C(\C#N)/C(=O)NCC3=CC=CC=C3 |
| InChIKey | XEELMYMTOVPLGV-CXUHLZMHSA-N |
Chemical Property Profile of (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide
Property Insights of (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide. The TPSA of 80.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide. Following Lipinski's Rule of Five, (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide?
The CAS number of (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide is 1110820-58-0.
What is the molecular formula of (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide?
The molecular formula of (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide is C20H18N2O4.
What is the molecular weight of (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide?
The molecular weight of (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide is 350.12665 g/mol.
Where can I buy (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide?
You can request a quote for (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide?
Yes, CoreyChem provides custom synthesis services for (E)-N-benzyl-2-cyano-3-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.