2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile
TL;DR: 2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile (CAS 353261-72-0) is a chemical compound with molecular formula C12H10N2O and molecular weight 198.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methyl-2-oxoquinolin-1-yl)acetonitrile
Also Known As: 2-(4-methyl-2-oxoquinolin-1-yl)acetonitrile, (4-methyl-2-oxo-1(2H)-quinolinyl)acetonitrile, 2-(4-methyl-2-oxo-quinolin-1-yl)acetonitrile, AI-204/31721013
| Molecular Formula | C12H10N2O |
|---|---|
| Molecular Weight | 198.08 g/mol |
| LogP | 1.8335 |
| Topological Polar Surface Area | 45.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 198.07932 |
| Heavy Atoms | 15 |
| Complexity | 605.02875 |
Chemical Identifiers
| CAS Number | 353261-72-0 |
|---|---|
| SMILES | CC1=CC(=O)N(C2=CC=CC=C12)CC#N |
Product Overview
2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile (CAS 353261-72-0), with molecular formula C12H10N2O and molecular weight 198.08 g/mol. IUPAC: 2-(4-methyl-2-oxoquinolin-1-yl)acetonitrile.
Chemical Property Profile of 2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile
Property Insights of 2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile
The XLogP value of 1.8335 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile. With a topological polar surface area (TPSA) of 45.79 Ų, 2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile has 0 hydrogen bond donor(s) and 2 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-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile?
The CAS number of 2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile is 353261-72-0.
What is the molecular formula of 2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile?
The molecular formula of 2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile is C12H10N2O.
What is the molecular weight of 2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile?
The molecular weight of 2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile is 198.08 g/mol.
Where can I buy 2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile?
You can request a quote for 2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methyl-2-oxoquinolin-1-yl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.