ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate
TL;DR: ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate (CAS 448912-17-2) is a chemical compound with molecular formula C18H23NO5 and molecular weight 333.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-ethoxycarbonyloxy-2,2,4-trimethylquinoline-1-carboxylate
Also Known As: ChemDiv3_003837, IDI1_021747, BRD-K77707744-001-01-2, ethyl 6-ethoxycarbonyloxy-2,2,4-trimethylquinoline-1-carboxylate, ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate
| Molecular Formula | C18H23NO5 |
|---|---|
| Molecular Weight | 333.16 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 65.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 333.15762 |
| Heavy Atoms | 24 |
| Complexity | 514.0 |
Chemical Identifiers
| CAS Number | 448912-17-2 |
|---|---|
| SMILES | CCOC(=O)N1C2=C(C=C(C=C2)OC(=O)OCC)C(=CC1(C)C)C |
| InChIKey | UWZZDZNGXRTAFU-UHFFFAOYSA-N |
Product Overview
ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate (CAS 448912-17-2), with molecular formula C18H23NO5 and molecular weight 333.16 g/mol. IUPAC: ethyl 6-ethoxycarbonyloxy-2,2,4-trimethylquinoline-1-carboxylate.
Chemical Property Profile of ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate
Property Insights of ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate
The XLogP value of 3.4 indicates that ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.1 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate. Following Lipinski's Rule of Five, ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate 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 ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate?
The CAS number of ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate is 448912-17-2.
What is the molecular formula of ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate?
The molecular formula of ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate is C18H23NO5.
What is the molecular weight of ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate?
The molecular weight of ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate is 333.16 g/mol.
Where can I buy ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate?
You can request a quote for ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 6-((ethoxycarbonyl)oxy)-2,2,4-trimethylquinoline-1(2H)-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.