![2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile structure](/static/products/2164/2164-79-6.webp)
2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile
TL;DR: 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile (CAS 2164-79-6) is a chemical compound with molecular formula C29H30N4O3 and molecular weight 482.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile
Also Known As: 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile, 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3, 2,2'-[2-(2-Methoxyphenyl)-1,3-diazinane-1,3-diyl]bis[(4-methoxyphenyl)acetonitrile]
| Molecular Formula | C29H30N4O3 |
|---|---|
| Molecular Weight | 482.23 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 81.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 482.23178 |
| Heavy Atoms | 36 |
| Complexity | 722.0 |
Chemical Identifiers
| CAS Number | 2164-79-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(C#N)N2CCCN(C2C3=CC=CC=C3OC)C(C#N)C4=CC=C(C=C4)OC |
| InChIKey | CSPBGFHJRVRVSW-UHFFFAOYSA-N |
Product Overview
2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile (CAS 2164-79-6), with molecular formula C29H30N4O3 and molecular weight 482.23 g/mol. IUPAC: 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile.
Chemical Property Profile of 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile
Property Insights of 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile
The XLogP value of 4.9 indicates that 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile. Following Lipinski's Rule of Five, 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile has 0 hydrogen bond donor(s) and 7 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-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile?
The CAS number of 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile is 2164-79-6.
What is the molecular formula of 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile?
The molecular formula of 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile is C29H30N4O3.
What is the molecular weight of 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile?
The molecular weight of 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile is 482.23 g/mol.
Where can I buy 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile?
You can request a quote for 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-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-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-[cyano-(4-methoxyphenyl)methyl]-2-(2-methoxyphenyl)-1,3-diazinan-1-yl]-2-(4-methoxyphenyl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.