Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate
TL;DR: Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate (CAS 132210-20-9) is a chemical compound with molecular formula C14H15NO3 and molecular weight 245.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl 2-oxo-1H-quinoline-4-carboxylate
Also Known As: isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate, 2-methylpropyl 2-hydroxyquinoline-4-carboxylate, 2-methylpropyl 2-oxo-1H-quinoline-4-carboxylate, isobutyl 2-oxo-1,2-dihydro-4-quinolinecarboxylate
| Molecular Formula | C14H15NO3 |
|---|---|
| Molecular Weight | 245.11 g/mol |
| LogP | 2.3409 |
| Topological Polar Surface Area | 59.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.1052 |
| Heavy Atoms | 18 |
| Complexity | 628.21686 |
Chemical Identifiers
| CAS Number | 132210-20-9 |
|---|---|
| SMILES | CC(C)COC(=O)C1=CC(=O)NC2=CC=CC=C21 |
Product Overview
Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate (CAS 132210-20-9), with molecular formula C14H15NO3 and molecular weight 245.11 g/mol. IUPAC: 2-methylpropyl 2-oxo-1H-quinoline-4-carboxylate.
Chemical Property Profile of Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate
Property Insights of Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate
The XLogP value of 2.3409 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate. With a topological polar surface area (TPSA) of 59.16 Ų, Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isobutyl 2-oxo-1,2-dihydroquinoline-4-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 Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate?
The CAS number of Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate is 132210-20-9.
What is the molecular formula of Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate?
The molecular formula of Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate is C14H15NO3.
What is the molecular weight of Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate?
The molecular weight of Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate is 245.11 g/mol.
Where can I buy Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate?
You can request a quote for Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Isobutyl 2-oxo-1,2-dihydroquinoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.