蓝刺头碱
TL;DR: 蓝刺头碱 (CAS 83-54-5) is a chemical compound with molecular formula C10H9NO and molecular weight 159.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
蓝刺头碱
1-methylquinolin-4-one
Also Known As: Echinopsine, 1-Methyl-4-quinolone, Echinopsin, 1-methylquinolin-4-one, 1-methylquinolin-4(1H)-one
| Molecular Formula | C10H9NO |
|---|---|
| Molecular Weight | 159.07 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 159.06842 |
| Heavy Atoms | 12 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 83-54-5 |
|---|---|
| SMILES | CN1C=CC(=O)C2=CC=CC=C21 |
| InChIKey | CSJAXRKDCCWCSJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
蓝刺头碱 (CAS 83-54-5), with molecular formula C10H9NO and molecular weight 159.07 g/mol. IUPAC: 1-methylquinolin-4-one.
Chemical Property Profile of 蓝刺头碱
Property Insights of 蓝刺头碱
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 蓝刺头碱. With a topological polar surface area (TPSA) of 20.3 Ų, 蓝刺头碱 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 蓝刺头碱 has 0 hydrogen bond donor(s) and 2 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 蓝刺头碱?
The CAS number of 蓝刺头碱 is 83-54-5.
What is the molecular formula of 蓝刺头碱?
The molecular formula of 蓝刺头碱 is C10H9NO.
What is the molecular weight of 蓝刺头碱?
The molecular weight of 蓝刺头碱 is 159.07 g/mol.
Where can I buy 蓝刺头碱?
You can request a quote for 蓝刺头碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 蓝刺头碱?
Yes, KEHONG BIO provides custom synthesis services for 蓝刺头碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.