Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate
TL;DR: Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate (CAS 17891-05-3) is a chemical compound with molecular formula C11H12ClNO3 and molecular weight 241.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-chloro-4-oxo-6,7,8,9-tetrahydroquinolizine-1-carboxylate
Also Known As: Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate, AE-406/41056326, Methyl 2-chloro-4-oxo-6,7,8,9-tetrahydroquinolizine-1-carboxylate, methyl 8-chloro-6-oxo-1,3,4,6-tetrahydro-2H-quinolizine-9-carboxylate, Methyl8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate
| Molecular Formula | C11H12ClNO3 |
|---|---|
| Molecular Weight | 241.05 g/mol |
| LogP | 1.6246 |
| Topological Polar Surface Area | 48.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 241.05057 |
| Heavy Atoms | 16 |
| Complexity | 492.73843 |
Chemical Identifiers
| CAS Number | 17891-05-3 |
|---|---|
| SMILES | COC(=O)C1=C2CCCCN2C(=O)C=C1Cl |
Product Overview
Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate (CAS 17891-05-3), with molecular formula C11H12ClNO3 and molecular weight 241.05 g/mol. IUPAC: methyl 2-chloro-4-oxo-6,7,8,9-tetrahydroquinolizine-1-carboxylate.
Chemical Property Profile of Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate
Property Insights of Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate
The XLogP value of 1.6246 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate. With a topological polar surface area (TPSA) of 48.3 Ų, Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate 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 Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate?
The CAS number of Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate is 17891-05-3.
What is the molecular formula of Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate?
The molecular formula of Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate is C11H12ClNO3.
What is the molecular weight of Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate?
The molecular weight of Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate is 241.05 g/mol.
Where can I buy Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate?
You can request a quote for Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 8-chloro-6-oxo-2,3,4,6-tetrahydro-1H-quinolizine-9-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.