Isopteleine
TL;DR: Isopteleine (CAS 2181-84-2) is a chemical compound with molecular formula C13H11NO3 and molecular weight 229.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxy-9-methylfuro[2,3-b]quinolin-4-one
Also Known As: Isopteleine, 6-Methoxyisodictamnine, 6-methoxy-9-methylfuro[2,3-b]quinolin-4-one, Isopteleine (6-Methoxyisodictamnine), AJ-738/21161013
| Molecular Formula | C13H11NO3 |
|---|---|
| Molecular Weight | 229.07 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 42.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 229.0739 |
| Heavy Atoms | 17 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 2181-84-2 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)OC)C(=O)C3=C1OC=C3 |
| InChIKey | XKTZVOMYVJKQTH-UHFFFAOYSA-N |
Product Overview
Isopteleine (CAS 2181-84-2), with molecular formula C13H11NO3 and molecular weight 229.07 g/mol. IUPAC: 6-methoxy-9-methylfuro[2,3-b]quinolin-4-one.
Chemical Property Profile of Isopteleine
Property Insights of Isopteleine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopteleine. With a topological polar surface area (TPSA) of 42.7 Ų, Isopteleine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopteleine has 0 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 Isopteleine?
The CAS number of Isopteleine is 2181-84-2.
What is the molecular formula of Isopteleine?
The molecular formula of Isopteleine is C13H11NO3.
What is the molecular weight of Isopteleine?
The molecular weight of Isopteleine is 229.07 g/mol.
Where can I buy Isopteleine?
You can request a quote for Isopteleine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopteleine?
Yes, KEHONG BIO provides custom synthesis services for Isopteleine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.