(E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide
TL;DR: (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide (CAS 358314-54-2) is a chemical compound with molecular formula C21H22N2O3 and molecular weight 350.16306 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide
Also Known As: (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide, N-benzyl-2-cyano-3-[3-methoxy-4-(propan-2-yloxy)phenyl]prop-2-enamide
Technical Specifications
| Molecular Formula | C21H22N2O3 |
| Molecular Weight | 350.16306 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 350.16306 Da |
| Heavy Atoms | 26 |
| Complexity | 529.0 |
| SMILES | CC(C)OC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NCC2=CC=CC=C2)OC |
| InChIKey | XVALWFOTDIAPMH-WOJGMQOQSA-N |
Chemical Property Profile of (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide
Property Insights of (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide
The XLogP value of 3.8 indicates that (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide. Following Lipinski's Rule of Five, (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide has 1 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 (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide?
The CAS number of (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide is 358314-54-2.
What is the molecular formula of (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide?
The molecular formula of (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide is C21H22N2O3.
What is the molecular weight of (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide?
The molecular weight of (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide is 350.16306 g/mol.
Where can I buy (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide?
You can request a quote for (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)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-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide?
Yes, CoreyChem provides custom synthesis services for (E)-N-benzyl-2-cyano-3-(3-methoxy-4-propan-2-yloxyphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.