1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
TL;DR: 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline (CAS 53790-93-5) is a chemical compound with molecular formula C29H42N2O4 and molecular weight 482.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[7-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)heptyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Also Known As: Hmbdti, J3.749.683I, 1-[7-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)heptyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline, 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline, 1,7-bis-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)heptane
| Molecular Formula | C29H42N2O4 |
|---|---|
| Molecular Weight | 482.31 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 61.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 482.31445 |
| Heavy Atoms | 35 |
| Complexity | 557.0 |
Chemical Identifiers
| CAS Number | 53790-93-5 |
|---|---|
| SMILES | COC1=C(C=C2C(NCCC2=C1)CCCCCCCC3C4=CC(=C(C=C4CCN3)OC)OC)OC |
| InChIKey | MKGZTQJHESLQAX-UHFFFAOYSA-N |
Product Overview
1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline (CAS 53790-93-5), with molecular formula C29H42N2O4 and molecular weight 482.31 g/mol. IUPAC: 1-[7-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)heptyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline.
Chemical Property Profile of 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Property Insights of 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
The XLogP value of 5.4 indicates that 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline 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 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline. Following Lipinski's Rule of Five, 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline?
The CAS number of 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline is 53790-93-5.
What is the molecular formula of 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline?
The molecular formula of 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline is C29H42N2O4.
What is the molecular weight of 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline?
The molecular weight of 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline is 482.31 g/mol.
Where can I buy 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline?
You can request a quote for 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 1'-Heptamethylene-bis-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.