Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate
TL;DR: Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate (CAS 30015-28-2) is a chemical compound with molecular formula C16H15Cl2NO3 and molecular weight 339.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(3,3-dichloroprop-2-enyl)-2-methyl-4-oxo-1H-quinoline-6-carboxylate
Also Known As: ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate, ethyl 3-(3,3-dichloroprop-2-en-1-yl)-4-hydroxy-2-methylquinoline-6-carboxylate, ethyl 3-(3,3-dichloroprop-2-enyl)-2-methyl-4-oxo-1H-quinoline-6-carboxylate, ethyl 3-(3,3-dichloroprop-2-enyl)-4-hydroxy-2-methylquinoline-6-carboxylate
| Molecular Formula | C16H15Cl2NO3 |
|---|---|
| Molecular Weight | 339.04 g/mol |
| LogP | 3.87472 |
| Topological Polar Surface Area | 59.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.0429 |
| Heavy Atoms | 22 |
| Complexity | 804.8785 |
Chemical Identifiers
| CAS Number | 30015-28-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(C=C1)NC(=C(C2=O)CC=C(Cl)Cl)C |
Product Overview
Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate (CAS 30015-28-2), with molecular formula C16H15Cl2NO3 and molecular weight 339.04 g/mol. IUPAC: ethyl 3-(3,3-dichloroprop-2-enyl)-2-methyl-4-oxo-1H-quinoline-6-carboxylate.
Chemical Property Profile of Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate
Property Insights of Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate
The XLogP value of 3.87472 indicates that Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.16 Ų, Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate has 1 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 Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate?
The CAS number of Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate is 30015-28-2.
What is the molecular formula of Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate?
The molecular formula of Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate is C16H15Cl2NO3.
What is the molecular weight of Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate?
The molecular weight of Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate is 339.04 g/mol.
Where can I buy Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate?
You can request a quote for Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(3,3-dichloroallyl)-4-hydroxy-2-methylquinoline-6-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.