Adlumine
TL;DR: Adlumine (CAS 38184-69-9) is a chemical compound with molecular formula C21H21NO6 and molecular weight 383.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6S)-6-[(1S)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]-6H-furo[3,4-g][1,3]benzodioxol-8-one
Also Known As: Adlumine, (+)-Adlumine, D-Adlumine, (+-)-Adlumine, O-Methylcorledine
| Molecular Formula | C21H21NO6 |
|---|---|
| Molecular Weight | 383.14 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 383.1369 |
| Heavy Atoms | 28 |
| Complexity | 601.0 |
Chemical Identifiers
| CAS Number | 38184-69-9 |
|---|---|
| SMILES | CN1CCC2=CC(=C(C=C2[C@H]1[C@@H]3C4=C(C5=C(C=C4)OCO5)C(=O)O3)OC)OC |
| InChIKey | SZDGAZFTAUFFQH-OALUTQOASA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Adlumine (CAS 38184-69-9), with molecular formula C21H21NO6 and molecular weight 383.14 g/mol. IUPAC: (6S)-6-[(1S)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]-6H-furo[3,4-g][1,3]benzodioxol-8-one.
Chemical Property Profile of Adlumine
Property Insights of Adlumine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Adlumine. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Adlumine. Following Lipinski's Rule of Five, Adlumine has 0 hydrogen bond donor(s) and 7 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 Adlumine?
The CAS number of Adlumine is 38184-69-9.
What is the molecular formula of Adlumine?
The molecular formula of Adlumine is C21H21NO6.
What is the molecular weight of Adlumine?
The molecular weight of Adlumine is 383.14 g/mol.
Where can I buy Adlumine?
You can request a quote for Adlumine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adlumine?
Yes, KEHONG BIO provides custom synthesis services for Adlumine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.