2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile
TL;DR: 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile (CAS 400089-36-3) is a chemical compound with molecular formula C14H11ClN2O and molecular weight 258.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6-chloro-2-pyridinyl)-2-(2-methoxyphenyl)acetonitrile
Also Known As: Bionet2_001683, 2-(6-chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile, 2-(6-chloro-2-pyridinyl)-2-(2-methoxyphenyl)acetonitrile, (6-Chloropyridin-2-yl)(2-methoxyphenyl)acetonitrile, BRD-A86462862-001-07-8
| Molecular Formula | C14H11ClN2O |
|---|---|
| Molecular Weight | 258.06 g/mol |
| LogP | 3.39908 |
| Topological Polar Surface Area | 45.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.056 |
| Heavy Atoms | 18 |
| Complexity | 592.343 |
Chemical Identifiers
| CAS Number | 400089-36-3 |
|---|---|
| SMILES | COC1=CC=CC=C1C(C#N)C2=NC(=CC=C2)Cl |
Product Overview
2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile (CAS 400089-36-3), with molecular formula C14H11ClN2O and molecular weight 258.06 g/mol. IUPAC: 2-(6-chloro-2-pyridinyl)-2-(2-methoxyphenyl)acetonitrile.
Chemical Property Profile of 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile
Property Insights of 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile
The XLogP value of 3.39908 indicates that 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.91 Ų, 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile has 0 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 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile?
The CAS number of 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile is 400089-36-3.
What is the molecular formula of 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile?
The molecular formula of 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile is C14H11ClN2O.
What is the molecular weight of 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile?
The molecular weight of 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile is 258.06 g/mol.
Where can I buy 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile?
You can request a quote for 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(6-Chloropyridin-2-yl)-2-(2-methoxyphenyl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.