3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide
TL;DR: 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide (CAS 302552-91-6) is a chemical compound with molecular formula C17H14N2O2 and molecular weight 278.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-(4-phenylmethoxyphenyl)prop-2-enamide
Also Known As: 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide, 3-[4-(benzyloxy)phenyl]-2-cyanoacrylamide, BAS 01119634, 3-(4-Benzyloxy-phenyl)-2-cyano-acrylamide, (E)-2-cyano-3-(4-phenylmethoxyphenyl)prop-2-enamide
| Molecular Formula | C17H14N2O2 |
|---|---|
| Molecular Weight | 278.11 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 76.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 278.10553 |
| Heavy Atoms | 21 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 302552-91-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)/C=C(\C#N)/C(=O)N |
| InChIKey | SIAMCDIHXZUXRD-XNTDXEJSSA-N |
Product Overview
3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide (CAS 302552-91-6), with molecular formula C17H14N2O2 and molecular weight 278.11 g/mol. IUPAC: (E)-2-cyano-3-(4-phenylmethoxyphenyl)prop-2-enamide.
Chemical Property Profile of 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide
Property Insights of 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide
The XLogP value of 3.0 indicates that 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide. Following Lipinski's Rule of Five, 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide has 1 hydrogen bond donor(s) and 3 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 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide?
The CAS number of 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide is 302552-91-6.
What is the molecular formula of 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide?
The molecular formula of 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide is C17H14N2O2.
What is the molecular weight of 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide?
The molecular weight of 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide is 278.11 g/mol.
Where can I buy 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide?
You can request a quote for 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-(Benzyloxy)phenyl)-2-cyanoacrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.