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[2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile
TL;DR: [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile (CAS 573972-10-8) is a chemical compound with molecular formula C22H20N2O2 and molecular weight 344.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methoxyanilino)-2-(2-phenylmethoxyphenyl)acetonitrile
Also Known As: [2-(benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile|2-(4-methoxyanilino)-2-(2-phenylmethoxyphenyl)acetonitrile|2-(2-(benzyloxy)phenyl)-2-((4-methoxyphenyl)amino)acetonitrile|SMR000198959|MLS000579524|BDBM50447014
| Molecular Formula | C22H20N2O2 |
|---|---|
| Molecular Weight | 344.15 g/mol |
| LogP | 4.95098 |
| Topological Polar Surface Area | 54.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 344.15247 |
| Heavy Atoms | 26 |
| Complexity | 870.64905 |
Chemical Identifiers
| CAS Number | 573972-10-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC(C#N)C2=CC=CC=C2OCC3=CC=CC=C3 |
Product Overview
[2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile (CAS 573972-10-8), with molecular formula C22H20N2O2 and molecular weight 344.15 g/mol. IUPAC: 2-(4-methoxyanilino)-2-(2-phenylmethoxyphenyl)acetonitrile.
Chemical Property Profile of [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile
Property Insights of [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile
The XLogP value of 4.95098 indicates that [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.28 Ų, [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile 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
Frequently Asked Questions
What is the CAS number of [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile?
The CAS number of [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile is 573972-10-8.
What is the molecular formula of [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile?
The molecular formula of [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile is C22H20N2O2.
What is the molecular weight of [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile?
The molecular weight of [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile is 344.15 g/mol.
Where can I buy [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile?
You can request a quote for [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for [2-(Benzyloxy)phenyl][(4-methoxyphenyl)amino]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.