5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline
TL;DR: 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline (CAS 902276-57-7) is a chemical compound with molecular formula C15H21NO2 and molecular weight 247.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline
Also Known As: 5-butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline, Isoquinoline, 5-butoxy-3,4-dihydro-6-methoxy-1-methyl-
| Molecular Formula | C15H21NO2 |
|---|---|
| Molecular Weight | 247.16 g/mol |
| LogP | 3.2392 |
| Topological Polar Surface Area | 30.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 247.15723 |
| Heavy Atoms | 18 |
| Complexity | 452.05197 |
Chemical Identifiers
| CAS Number | 902276-57-7 |
|---|---|
| SMILES | CCCCOC1=C(C=CC2=C1CCN=C2C)OC |
Product Overview
5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline (CAS 902276-57-7), with molecular formula C15H21NO2 and molecular weight 247.16 g/mol. IUPAC: 5-butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline.
Chemical Property Profile of 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline
Property Insights of 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline
The XLogP value of 3.2392 indicates that 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.82 Ų, 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline has 0 hydrogen bond donor(s) and 3 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 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline?
The CAS number of 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline is 902276-57-7.
What is the molecular formula of 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline?
The molecular formula of 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline is C15H21NO2.
What is the molecular weight of 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline?
The molecular weight of 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline is 247.16 g/mol.
Where can I buy 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline?
You can request a quote for 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 5-Butoxy-6-methoxy-1-methyl-3,4-dihydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.