1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline
TL;DR: 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline (CAS 634180-45-3) is a chemical compound with molecular formula C18H20N2 and molecular weight 264.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,2,3,4-tetrahydroisoquinolin-1-yl)-1,2,3,4-tetrahydroisoquinoline
Also Known As: 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline, J1.959.836E, (1R,1'R)-1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline, (1S,1'S)-1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline, 1H,1'H,2H,2'H,3H,3'H,4H,4'H-1,1'-biisoquinoline
| Molecular Formula | C18H20N2 |
|---|---|
| Molecular Weight | 264.16 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 24.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 264.16266 |
| Heavy Atoms | 20 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 634180-45-3 |
|---|---|
| SMILES | C1CNC(C2=CC=CC=C21)C3C4=CC=CC=C4CCN3 |
| InChIKey | NDHNLLQPMVDMRO-UHFFFAOYSA-N |
Product Overview
1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline (CAS 634180-45-3), with molecular formula C18H20N2 and molecular weight 264.16 g/mol. IUPAC: 1-(1,2,3,4-tetrahydroisoquinolin-1-yl)-1,2,3,4-tetrahydroisoquinoline.
Chemical Property Profile of 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline
Property Insights of 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline. With a topological polar surface area (TPSA) of 24.1 Ų, 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline has 2 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 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline?
The CAS number of 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline is 634180-45-3.
What is the molecular formula of 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline?
The molecular formula of 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline is C18H20N2.
What is the molecular weight of 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline?
The molecular weight of 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline is 264.16 g/mol.
Where can I buy 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline?
You can request a quote for 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 1,1',2,2',3,3',4,4'-Octahydro-1,1'-biisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.