Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide
TL;DR: Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide (CAS 31756-15-7) is a chemical compound with molecular formula C18H22BrNO2 and molecular weight 363.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium bromide
Also Known As: 2-Benzyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline hydrobromide, ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-2-BENZYL-6,7-DIMETHOXY-, HYDROBROMIDE, 2-benzyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium bromide, 2-benzyl-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-ium bromide, Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-2-(phenylmethyl)-, hydrobromide
| Molecular Formula | C18H22BrNO2 |
|---|---|
| Molecular Weight | 363.08 g/mol |
| LogP | -1.15 |
| Topological Polar Surface Area | 22.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 363.0834 |
| Heavy Atoms | 22 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 31756-15-7 |
|---|---|
| SMILES | COC1=C(C=C2C[NH+](CCC2=C1)CC3=CC=CC=C3)OC.[Br-] |
| InChIKey | NHMWEBZBZYZFHT-UHFFFAOYSA-N |
Product Overview
Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide (CAS 31756-15-7), with molecular formula C18H22BrNO2 and molecular weight 363.08 g/mol. IUPAC: 2-benzyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium bromide.
Chemical Property Profile of Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide
Property Insights of Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide
The XLogP value of -1.15 indicates that Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 22.9 Ų, Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide 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 Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide?
The CAS number of Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide is 31756-15-7.
What is the molecular formula of Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide?
The molecular formula of Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide is C18H22BrNO2.
What is the molecular weight of Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide?
The molecular weight of Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide is 363.08 g/mol.
Where can I buy Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide?
You can request a quote for Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for Isoquinoline, 1,2,3,4-tetrahydro-2-benzyl-6,7-dimethoxy-, hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.