4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile
TL;DR: 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile (CAS 172984-76-8) is a chemical compound with molecular formula C22H22N4 and molecular weight 342.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(dibenzylamino)-2-(dimethylamino)pyridine-3-carbonitrile
Also Known As: 4-(dibenzylamino)-2-(dimethylamino)nicotinonitrile, 4-(dibenzylamino)-2-(dimethylamino)pyridine-3-carbonitrile, BIM-0042504.P001, 2-dimethylamino-3-cyano-4-dibenzylaminopyridine, AH-262/31837025
| Molecular Formula | C22H22N4 |
|---|---|
| Molecular Weight | 342.18 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 43.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 342.18445 |
| Heavy Atoms | 26 |
| Complexity | 436.0 |
Chemical Identifiers
| CAS Number | 172984-76-8 |
|---|---|
| SMILES | CN(C)C1=NC=CC(=C1C#N)N(CC2=CC=CC=C2)CC3=CC=CC=C3 |
| InChIKey | FSZZPPMHTJCPBD-UHFFFAOYSA-N |
Product Overview
4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile (CAS 172984-76-8), with molecular formula C22H22N4 and molecular weight 342.18 g/mol. IUPAC: 4-(dibenzylamino)-2-(dimethylamino)pyridine-3-carbonitrile.
Chemical Property Profile of 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile
Property Insights of 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile
The XLogP value of 4.1 indicates that 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.2 Ų, 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile has 0 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 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile?
The CAS number of 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile is 172984-76-8.
What is the molecular formula of 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile?
The molecular formula of 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile is C22H22N4.
What is the molecular weight of 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile?
The molecular weight of 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile is 342.18 g/mol.
Where can I buy 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile?
You can request a quote for 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-(Dibenzylamino)-2-(dimethylamino)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.