2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate
TL;DR: 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate (CAS 38428-14-7) is a chemical compound with molecular formula C18H25NO3 and molecular weight 303.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl 2-(2-methylpropoxy)-2H-quinoline-1-carboxylate
Also Known As: IIDQ, Isobutyl 2-isobutoxyquinoline-1(2H)-carboxylate, 1-Isobutoxycarbonyl-2-isobutoxy-1,2-dihydroquinoline, isobutyl 1,2-dihydro-2-isobutoxy-1-quinoline-carboxylate, 2-Isobutoxy-1-isobutoxycarbonyl-1,2-dihydroquinoline
| Molecular Formula | C18H25NO3 |
|---|---|
| Molecular Weight | 303.18 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 303.18344 |
| Heavy Atoms | 22 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 38428-14-7 |
|---|---|
| SMILES | CC(C)COC1C=CC2=CC=CC=C2N1C(=O)OCC(C)C |
| InChIKey | LPBHYOYZZIFCQT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate (CAS 38428-14-7), with molecular formula C18H25NO3 and molecular weight 303.18 g/mol. IUPAC: 2-methylpropyl 2-(2-methylpropoxy)-2H-quinoline-1-carboxylate.
Chemical Property Profile of 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate
Property Insights of 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate
The XLogP value of 4.7 indicates that 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate 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 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate?
The CAS number of 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate is 38428-14-7.
What is the molecular formula of 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate?
The molecular formula of 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate is C18H25NO3.
What is the molecular weight of 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate?
The molecular weight of 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate is 303.18 g/mol.
Where can I buy 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate?
You can request a quote for 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylpropyl 2-(2-methylpropoxy)-1(2H)-quinolinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.