ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate
TL;DR: ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate (CAS 40448-81-5) is a chemical compound with molecular formula C14H12N2O2 and molecular weight 240.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate
Also Known As: ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate, ethenyl 2-cyano-6-methylquinoline-1(2H)-carboxylate
| Molecular Formula | C14H12N2O2 |
|---|---|
| Molecular Weight | 240.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 53.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.08987 |
| Heavy Atoms | 18 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 40448-81-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(C(C=C2)C#N)C(=O)OC=C |
| InChIKey | DJFQWKGKANUZJQ-UHFFFAOYSA-N |
Product Overview
ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate (CAS 40448-81-5), with molecular formula C14H12N2O2 and molecular weight 240.09 g/mol. IUPAC: ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate.
Chemical Property Profile of ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate
Property Insights of ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate. With a topological polar surface area (TPSA) of 53.3 Ų, ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate has 0 hydrogen bond donor(s) and 3 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 ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate?
The CAS number of ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate is 40448-81-5.
What is the molecular formula of ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate?
The molecular formula of ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate is C14H12N2O2.
What is the molecular weight of ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate?
The molecular weight of ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate is 240.09 g/mol.
Where can I buy ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate?
You can request a quote for ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethenyl 2-cyano-6-methyl-2H-quinoline-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.