7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline
TL;DR: 7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline (CAS 654053-39-1) is a chemical compound with molecular formula C13H17NO2 and molecular weight 219.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxy-1,3,3-trimethyl-4H-isoquinolin-7-ol
Also Known As: ChemDiv3_014878, 6-methoxy-1,3,3-trimethyl-4H-isoquinolin-7-ol, 7-Isoquinolinol, 3,4-dihydro-6-methoxy-1,3,3-trimethyl-, A2974/0125330, 7-hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline
| Molecular Formula | C13H17NO2 |
|---|---|
| Molecular Weight | 219.13 g/mol |
| LogP | 2.5445 |
| Topological Polar Surface Area | 41.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 219.12593 |
| Heavy Atoms | 16 |
| Complexity | 461.24554 |
Chemical Identifiers
| CAS Number | 654053-39-1 |
|---|---|
| SMILES | CC1=NC(CC2=CC(=C(C=C12)O)OC)(C)C |
Product Overview
7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline (CAS 654053-39-1), with molecular formula C13H17NO2 and molecular weight 219.13 g/mol. IUPAC: 6-methoxy-1,3,3-trimethyl-4H-isoquinolin-7-ol.
Chemical Property Profile of 7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline
Property Insights of 7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline
The XLogP value of 2.5445 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline. With a topological polar surface area (TPSA) of 41.82 Ų, 7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline has 1 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 7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline?
The CAS number of 7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline is 654053-39-1.
What is the molecular formula of 7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline?
The molecular formula of 7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline is C13H17NO2.
What is the molecular weight of 7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline?
The molecular weight of 7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline is 219.13 g/mol.
Where can I buy 7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline?
You can request a quote for 7-Hydroxy-6-methoxy-1,3,3-trimethyl-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 7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 7-Hydroxy-6-methoxy-1,3,3-trimethyl-3,4-dihydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.