Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate
TL;DR: Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate (CAS 934140-69-9) is a chemical compound with molecular formula C16H15N3O2 and molecular weight 281.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-cyano-3-[(2-methylquinolin-4-yl)amino]prop-2-enoate
Also Known As: ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate, Ethyl 2-cyano-3-[(2-methylquinolin-4-yl)amino]prop-2-enoate, ethyl 2-cyano-3-[(2-methyl-4-quinolyl)amino]prop-2-enoate, ethyl (2Z)-2-cyano-3-[(2-methylquinolin-4-yl)amino]prop-2-enoate
| Molecular Formula | C16H15N3O2 |
|---|---|
| Molecular Weight | 281.12 g/mol |
| LogP | 2.9257 |
| Topological Polar Surface Area | 75.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.11642 |
| Heavy Atoms | 21 |
| Complexity | 744.76074 |
Chemical Identifiers
| CAS Number | 934140-69-9 |
|---|---|
| SMILES | CCOC(=O)C(=CNC1=CC(=NC2=CC=CC=C21)C)C#N |
Product Overview
Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate (CAS 934140-69-9), with molecular formula C16H15N3O2 and molecular weight 281.12 g/mol. IUPAC: ethyl 2-cyano-3-[(2-methylquinolin-4-yl)amino]prop-2-enoate.
Chemical Property Profile of Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate
Property Insights of Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate
The XLogP value of 2.9257 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate. The TPSA of 75.01 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate. Following Lipinski's Rule of Five, Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate has 1 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 Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate?
The CAS number of Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate is 934140-69-9.
What is the molecular formula of Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate?
The molecular formula of Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate is C16H15N3O2.
What is the molecular weight of Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate?
The molecular weight of Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate is 281.12 g/mol.
Where can I buy Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate?
You can request a quote for Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-nitrilo-3-((2-methyl(4-quinolyl))amino)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.