Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1)
TL;DR: Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1) (CAS 63816-10-4) is a chemical compound with molecular formula C17H16BrNO and molecular weight 329.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-6-methoxyquinolin-1-ium bromide
Also Known As: 1-benzyl-6-methoxyquinoliniumbromide, Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide, n-benzyl-6-methoxyquinolinium bromide, 1-benzyl-6-methoxyquinolin-1-ium bromide, Diaethylamino-cyanphosphinsaeure-aethylester
| Molecular Formula | C17H16BrNO |
|---|---|
| Molecular Weight | 329.04 g/mol |
| LogP | 0.19 |
| Topological Polar Surface Area | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.04153 |
| Heavy Atoms | 20 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 63816-10-4 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)[N+](=CC=C2)CC3=CC=CC=C3.[Br-] |
| InChIKey | KLOXHFPRGMBVIB-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1) (CAS 63816-10-4), with molecular formula C17H16BrNO and molecular weight 329.04 g/mol. IUPAC: 1-benzyl-6-methoxyquinolin-1-ium bromide.
Chemical Property Profile of Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1)
Property Insights of Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1)
The XLogP value of 0.19 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1). With a topological polar surface area (TPSA) of 13.1 Ų, Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1) has 0 hydrogen bond donor(s) and 2 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 Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1)?
The CAS number of Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1) is 63816-10-4.
What is the molecular formula of Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1)?
The molecular formula of Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1) is C17H16BrNO.
What is the molecular weight of Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1)?
The molecular weight of Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1) is 329.04 g/mol.
Where can I buy Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1)?
You can request a quote for Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Quinolinium, 6-methoxy-1-(phenylmethyl)-, bromide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.