5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile
TL;DR: 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile (CAS 306979-88-4) is a chemical compound with molecular formula C19H20N4O and molecular weight 320.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetyl-6-methyl-2-(4-phenylpiperazin-1-yl)pyridine-3-carbonitrile
Also Known As: 5-acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile, 5-acetyl-6-methyl-2-(4-phenylpiperazin-1-yl)pyridine-3-carbonitrile
| Molecular Formula | C19H20N4O |
|---|---|
| Molecular Weight | 320.16 g/mol |
| LogP | 2.7909 |
| Topological Polar Surface Area | 60.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.1637 |
| Heavy Atoms | 24 |
| Complexity | 787.00433 |
Chemical Identifiers
| CAS Number | 306979-88-4 |
|---|---|
| SMILES | CC1=C(C=C(C(=N1)N2CCN(CC2)C3=CC=CC=C3)C#N)C(=O)C |
Product Overview
5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile (CAS 306979-88-4), with molecular formula C19H20N4O and molecular weight 320.16 g/mol. IUPAC: 5-acetyl-6-methyl-2-(4-phenylpiperazin-1-yl)pyridine-3-carbonitrile.
Chemical Property Profile of 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile
Property Insights of 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile
The XLogP value of 2.7909 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile. The TPSA of 60.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile. Following Lipinski's Rule of Five, 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile 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 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile?
The CAS number of 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile is 306979-88-4.
What is the molecular formula of 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile?
The molecular formula of 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile is C19H20N4O.
What is the molecular weight of 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile?
The molecular weight of 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile is 320.16 g/mol.
Where can I buy 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile?
You can request a quote for 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-Acetyl-6-methyl-2-(4-phenylpiperazino)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.