![2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile structure](/static/products/2164/2164-70-7.webp)
2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile
TL;DR: 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile (CAS 2164-70-7) is a chemical compound with molecular formula C26H24N4O and molecular weight 408.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[cyano(phenyl)methyl]-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenylacetonitrile
Also Known As: 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile, 2-[3-[cyano(phenyl)methyl]-2-(2-hydroxyphenyl)-1,3-diazinan-, 2,2'-[2-(2-Hydroxyphenyl)-1,3-diazinane-1,3-diyl]bis(phenylacetonitrile), 2-[3-[cyano(phenyl)methyl]-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenylacetonitrile
| Molecular Formula | C26H24N4O |
|---|---|
| Molecular Weight | 408.19 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 74.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 408.195 |
| Heavy Atoms | 31 |
| Complexity | 619.0 |
Chemical Identifiers
| CAS Number | 2164-70-7 |
|---|---|
| SMILES | C1CN(C(N(C1)C(C#N)C2=CC=CC=C2)C3=CC=CC=C3O)C(C#N)C4=CC=CC=C4 |
| InChIKey | URGZWCGWLFKZMA-UHFFFAOYSA-N |
Product Overview
2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile (CAS 2164-70-7), with molecular formula C26H24N4O and molecular weight 408.19 g/mol. IUPAC: 2-[3-[cyano(phenyl)methyl]-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenylacetonitrile.
Chemical Property Profile of 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile
Property Insights of 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile
The XLogP value of 4.7 indicates that 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile. Following Lipinski's Rule of Five, 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile 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
Frequently Asked Questions
What is the CAS number of 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile?
The CAS number of 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile is 2164-70-7.
What is the molecular formula of 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile?
The molecular formula of 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile is C26H24N4O.
What is the molecular weight of 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile?
The molecular weight of 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile is 408.19 g/mol.
Where can I buy 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile?
You can request a quote for 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(cyano-phenyl-methyl)-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.