2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate
TL;DR: 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate (CAS 879053-57-3) is a chemical compound with molecular formula C19H17NO3S and molecular weight 339.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxo-2-thiophen-2-ylethyl) 2-propan-2-ylquinoline-4-carboxylate
Also Known As: ASN 14407553, 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate, (2-oxo-2-thiophen-2-ylethyl) 2-propan-2-ylquinoline-4-carboxylate, 2-Isopropyl-quinoline-4-carboxylic acid 2-oxo-2-thiophen-2-yl-ethyl ester, 2-Oxo-2-(thiophen-2-yl)ethyl 2-(propan-2-yl)quinoline-4-carboxylate
| Molecular Formula | C19H17NO3S |
|---|---|
| Molecular Weight | 339.09 g/mol |
| LogP | 4.4594 |
| Topological Polar Surface Area | 56.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.09293 |
| Heavy Atoms | 24 |
| Complexity | 884.77313 |
Chemical Identifiers
| CAS Number | 879053-57-3 |
|---|---|
| SMILES | CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)C3=CC=CS3 |
Product Overview
2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate (CAS 879053-57-3), with molecular formula C19H17NO3S and molecular weight 339.09 g/mol. IUPAC: (2-oxo-2-thiophen-2-ylethyl) 2-propan-2-ylquinoline-4-carboxylate.
Chemical Property Profile of 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate
Property Insights of 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate
The XLogP value of 4.4594 indicates that 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.26 Ų, 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate 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 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate?
The CAS number of 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate is 879053-57-3.
What is the molecular formula of 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate?
The molecular formula of 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate is C19H17NO3S.
What is the molecular weight of 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate?
The molecular weight of 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate is 339.09 g/mol.
Where can I buy 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate?
You can request a quote for 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxo-2-(2-thienyl)ethyl 2-(1-methylethyl)-4-quinolinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.