1-Methyl-3,4-dihydroisoquinoline
TL;DR: 1-Methyl-3,4-dihydroisoquinoline (CAS 31595-63-8) is a chemical compound with molecular formula C10H11N and molecular weight 145.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3,4-dihydroisoquinoline
Also Known As: 1-Methyl-3,4-dihydroisoquinoline, 1MeDIQ compound, 3,4-Dihydro-1-methylisoquinoline, 1-methyl-3,4-dihyroisoquinoline, 1-methyl-3,4 dihydroisoquinoline
| Molecular Formula | C10H11N |
|---|---|
| Molecular Weight | 145.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 145.08914 |
| Heavy Atoms | 11 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 31595-63-8 |
|---|---|
| SMILES | CC1=NCCC2=CC=CC=C12 |
| InChIKey | JZZLDIIDMFCOGF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-3,4-dihydroisoquinoline (CAS 31595-63-8), with molecular formula C10H11N and molecular weight 145.09 g/mol. IUPAC: 1-methyl-3,4-dihydroisoquinoline.
Chemical Property Profile of 1-Methyl-3,4-dihydroisoquinoline
Property Insights of 1-Methyl-3,4-dihydroisoquinoline
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-3,4-dihydroisoquinoline. With a topological polar surface area (TPSA) of 12.4 Ų, 1-Methyl-3,4-dihydroisoquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-3,4-dihydroisoquinoline has 0 hydrogen bond donor(s) and 1 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-Methyl-3,4-dihydroisoquinoline?
The CAS number of 1-Methyl-3,4-dihydroisoquinoline is 31595-63-8.
What is the molecular formula of 1-Methyl-3,4-dihydroisoquinoline?
The molecular formula of 1-Methyl-3,4-dihydroisoquinoline is C10H11N.
What is the molecular weight of 1-Methyl-3,4-dihydroisoquinoline?
The molecular weight of 1-Methyl-3,4-dihydroisoquinoline is 145.09 g/mol.
Where can I buy 1-Methyl-3,4-dihydroisoquinoline?
You can request a quote for 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 1-Methyl-3,4-dihydroisoquinoline?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3,4-dihydroisoquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.