6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline
TL;DR: 6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline (CAS 82083-86-1) 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.
6,7-dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline
Also Known As: ChemDiv2_004966, IDI1_003681, 6,7-dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline, 1-Isobutyl-6,7-dimethoxy-3,4-dihydro-isoquinoline, 1-ISOBUTYL-6,7-DIMETHOXY-3,4-DIHYDROISOQUINOLINE
| Molecular Formula | C15H21NO2 |
|---|---|
| Molecular Weight | 247.16 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 30.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 247.15723 |
| Heavy Atoms | 18 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 82083-86-1 |
|---|---|
| SMILES | CC(C)CC1=NCCC2=CC(=C(C=C21)OC)OC |
| InChIKey | COAYVFJQIHKDGW-UHFFFAOYSA-N |
Product Overview
6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline (CAS 82083-86-1), with molecular formula C15H21NO2 and molecular weight 247.16 g/mol. IUPAC: 6,7-dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline.
Chemical Property Profile of 6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline
Property Insights of 6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline. With a topological polar surface area (TPSA) of 30.8 Ų, 6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-Dimethoxy-1-(2-methylpropyl)-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 6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline?
The CAS number of 6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline is 82083-86-1.
What is the molecular formula of 6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline?
The molecular formula of 6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline is C15H21NO2.
What is the molecular weight of 6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline?
The molecular weight of 6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline is 247.16 g/mol.
Where can I buy 6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline?
You can request a quote for 6,7-Dimethoxy-1-(2-methylpropyl)-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 6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 6,7-Dimethoxy-1-(2-methylpropyl)-3,4-dihydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.