Bisobrine
TL;DR: Bisobrine (CAS 22407-74-5) is a chemical compound with molecular formula C26H36N2O4 and molecular weight 440.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)butyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Also Known As: Bisobrine, BISOBRIN, 1,4-bis-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)butane, 1-[4-(6,7-dimethoxy-1,2,3,4-tetrahydro-1-isoquinolinyl)butyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline, 1-[4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)butyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
| Molecular Formula | C26H36N2O4 |
|---|---|
| Molecular Weight | 440.27 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 61.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 440.26752 |
| Heavy Atoms | 32 |
| Complexity | 516.0 |
Chemical Identifiers
| CAS Number | 22407-74-5 |
|---|---|
| SMILES | COC1=C(C=C2C(NCCC2=C1)CCCCC3C4=CC(=C(C=C4CCN3)OC)OC)OC |
| InChIKey | CYVSPLIJDCJRGR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bisobrine (CAS 22407-74-5), with molecular formula C26H36N2O4 and molecular weight 440.27 g/mol. IUPAC: 1-[4-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)butyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline.
Chemical Property Profile of Bisobrine
Property Insights of Bisobrine
The XLogP value of 3.8 indicates that Bisobrine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bisobrine. Following Lipinski's Rule of Five, Bisobrine has 2 hydrogen bond donor(s) and 6 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 Bisobrine?
The CAS number of Bisobrine is 22407-74-5.
What is the molecular formula of Bisobrine?
The molecular formula of Bisobrine is C26H36N2O4.
What is the molecular weight of Bisobrine?
The molecular weight of Bisobrine is 440.27 g/mol.
Where can I buy Bisobrine?
You can request a quote for Bisobrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bisobrine?
Yes, KEHONG BIO provides custom synthesis services for Bisobrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.