2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile
TL;DR: 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile (CAS 331979-93-2) is a chemical compound with molecular formula C23H23N3O and molecular weight 357.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-5-butyl-4-(4-methoxyphenyl)-6-phenylpyridine-3-carbonitrile
Also Known As: BAS 00727637, 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile, 2-Amino-5-butyl-4-(4-methoxy-phenyl)-6-phenyl-nicotinonitrile, 2-amino-5-butyl-4-(4-methoxyphenyl)-6-phenylpyridine-3-carbonitrile
| Molecular Formula | C23H23N3O |
|---|---|
| Molecular Weight | 357.18 g/mol |
| LogP | 5.22068 |
| Topological Polar Surface Area | 71.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 357.1841 |
| Heavy Atoms | 27 |
| Complexity | 957.65393 |
Chemical Identifiers
| CAS Number | 331979-93-2 |
|---|---|
| SMILES | CCCCC1=C(C(=C(N=C1C2=CC=CC=C2)N)C#N)C3=CC=C(C=C3)OC |
Product Overview
2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile (CAS 331979-93-2), with molecular formula C23H23N3O and molecular weight 357.18 g/mol. IUPAC: 2-amino-5-butyl-4-(4-methoxyphenyl)-6-phenylpyridine-3-carbonitrile.
Chemical Property Profile of 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile
Property Insights of 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile
The XLogP value of 5.22068 indicates that 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile. Following Lipinski's Rule of Five, 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile?
The CAS number of 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile is 331979-93-2.
What is the molecular formula of 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile?
The molecular formula of 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile is C23H23N3O.
What is the molecular weight of 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile?
The molecular weight of 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile is 357.18 g/mol.
Where can I buy 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile?
You can request a quote for 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-5-butyl-4-(4-methoxyphenyl)-6-phenylnicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.