2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile
TL;DR: 2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile (CAS 340816-84-4) is a chemical compound with molecular formula C25H24N4OS and molecular weight 428.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl-4,6-diphenylpyridine-3-carbonitrile
Also Known As: 2-((2-(4-methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile, 2-{[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-4,6-diphenylpyridine-3-carbonitrile, F3358-0046, 2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl-4,6-diphenylpyridine-3-carbonitrile, 2-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]sulfanyl-4,6-diphenyl-pyridine-3-carbonitrile
| Molecular Formula | C25H24N4OS |
|---|---|
| Molecular Weight | 428.17 g/mol |
| LogP | 4.15338 |
| Topological Polar Surface Area | 60.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.16708 |
| Heavy Atoms | 31 |
| Complexity | 1087.7549 |
Chemical Identifiers
| CAS Number | 340816-84-4 |
|---|---|
| SMILES | CN1CCN(CC1)C(=O)CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C#N |
Product Overview
2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile (CAS 340816-84-4), with molecular formula C25H24N4OS and molecular weight 428.17 g/mol. IUPAC: 2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]sulfanyl-4,6-diphenylpyridine-3-carbonitrile.
Chemical Property Profile of 2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile
Property Insights of 2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile
The XLogP value of 4.15338 indicates that 2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile. Following Lipinski's Rule of Five, 2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile has 0 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-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile?
The CAS number of 2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile is 340816-84-4.
What is the molecular formula of 2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile?
The molecular formula of 2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile is C25H24N4OS.
What is the molecular weight of 2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile?
The molecular weight of 2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile is 428.17 g/mol.
Where can I buy 2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile?
You can request a quote for 2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-((2-(4-Methylpiperazin-1-yl)-2-oxoethyl)thio)-4,6-diphenylnicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.