KF 18259
TL;DR: KF 18259 (CAS 139094-48-7) is a chemical compound with molecular formula C22H29ClN2O3 and molecular weight 404.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 1-(2-methylpropyl)-2-oxoquinoline-4-carboxylate;hydrochloride
Also Known As: KF 18259, endo-(8-Methyl-8-aza-bicyclo(3.2.1)oct-3-yl)-1-isobutyl-2-oxo-1,2-dihydro-4-quinolinecarboxylate hydrochloride, 4-Quinolinecarboxylic acid, 1,2-dihydro-1-(2-methylpropyl)-2-oxo-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, monohydrochloride, endo-, (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 1-(2-methylpropyl)-2-oxoquinoline-4-carboxylate hydrochloride, 8-Methyl-8-azabicyclo[3.2.1]octan-3-yl 1-(2-methylpropyl)-2-oxo-1,2-dihydroquinoline-4-carboxylate--hydrogen chloride (1/1)
| Molecular Formula | C22H29ClN2O3 |
|---|---|
| Molecular Weight | 404.19 g/mol |
| LogP | 3.8613 |
| Topological Polar Surface Area | 49.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 404.18668 |
| Heavy Atoms | 28 |
| Complexity | 615.0 |
Chemical Identifiers
| CAS Number | 139094-48-7 |
|---|---|
| SMILES | CC(C)CN1C2=CC=CC=C2C(=CC1=O)C(=O)OC3CC4CCC(C3)N4C.Cl |
| InChIKey | KXESITMAGBVRTM-UHFFFAOYSA-N |
Product Overview
KF 18259 (CAS 139094-48-7), with molecular formula C22H29ClN2O3 and molecular weight 404.19 g/mol. IUPAC: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 1-(2-methylpropyl)-2-oxoquinoline-4-carboxylate;hydrochloride.
Chemical Property Profile of KF 18259
Property Insights of KF 18259
The XLogP value of 3.8613 indicates that KF 18259 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.9 Ų, KF 18259 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KF 18259 has 1 hydrogen bond donor(s) and 4 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 KF 18259?
The CAS number of KF 18259 is 139094-48-7.
What is the molecular formula of KF 18259?
The molecular formula of KF 18259 is C22H29ClN2O3.
What is the molecular weight of KF 18259?
The molecular weight of KF 18259 is 404.19 g/mol.
Where can I buy KF 18259?
You can request a quote for KF 18259 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KF 18259?
Yes, KEHONG BIO provides custom synthesis services for KF 18259 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.