Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate
TL;DR: Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate (CAS 959290-57-4) is a chemical compound with molecular formula C15H19NO2 and molecular weight 245.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2,2,4-trimethyl-1H-quinoline-6-carboxylate
Also Known As: Ethyl 2,2,4-trimethyl-1,2-dihydroquinoline-6-carboxylate, ethyl 2,2,4-trimethyl-1H-quinoline-6-carboxylate, Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate, 2,2,4-Trimethyl-1,2-dihydro-quinoline-6-carboxylic, Ethyl2,2,4-trimethyl-1,2-dihydroquinoline-6-carboxylate
| Molecular Formula | C15H19NO2 |
|---|---|
| Molecular Weight | 245.14 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.14159 |
| Heavy Atoms | 18 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 959290-57-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(C=C1)NC(C=C2C)(C)C |
| InChIKey | SPTWHGASFFFKIB-UHFFFAOYSA-N |
Product Overview
Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate (CAS 959290-57-4), with molecular formula C15H19NO2 and molecular weight 245.14 g/mol. IUPAC: ethyl 2,2,4-trimethyl-1H-quinoline-6-carboxylate.
Chemical Property Profile of Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate
Property Insights of Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate
The XLogP value of 3.0 indicates that Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate 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 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate?
The CAS number of Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate is 959290-57-4.
What is the molecular formula of Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate?
The molecular formula of Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate is C15H19NO2.
What is the molecular weight of Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate?
The molecular weight of Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate is 245.14 g/mol.
Where can I buy Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate?
You can request a quote for Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1,2-dihydro-2,2,4-trimethyl-6-quinolinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.