4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile
TL;DR: 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile (CAS 7475-82-3) is a chemical compound with molecular formula C23H28N2 and molecular weight 332.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile
Also Known As: 4-(azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile, 4-(azepan-1-yl)-3-methyl-2,2-diphenyl-butanenitrile
| Molecular Formula | C23H28N2 |
|---|---|
| Molecular Weight | 332.23 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 332.22525 |
| Heavy Atoms | 25 |
| Complexity | 410.0 |
Chemical Identifiers
| CAS Number | 7475-82-3 |
|---|---|
| SMILES | CC(CN1CCCCCC1)C(C#N)(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | SFALPZNMBQNSLE-UHFFFAOYSA-N |
Product Overview
4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile (CAS 7475-82-3), with molecular formula C23H28N2 and molecular weight 332.23 g/mol. IUPAC: 4-(azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile.
Chemical Property Profile of 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile
Property Insights of 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile
The XLogP value of 5.1 indicates that 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.0 Ų, 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile?
The CAS number of 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile is 7475-82-3.
What is the molecular formula of 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile?
The molecular formula of 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile is C23H28N2.
What is the molecular weight of 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile?
The molecular weight of 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile is 332.23 g/mol.
Where can I buy 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile?
You can request a quote for 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-(Azepan-1-yl)-3-methyl-2,2-diphenylbutanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.