Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide
TL;DR: Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide (CAS 64059-44-5) is a chemical compound with molecular formula C17H24Br2N2O and molecular weight 430.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-isoquinolin-2-ium-2-ylpropyl)-4-methylmorpholin-4-ium dibromide
Also Known As: IN 265, ISOQUINOLINIUM, 2-(3-(4-METHYLMORPHOLINO)PROPYL)-, DIBROMIDE, Morpholinium, 4-(3-(isoquinolinio)propyl)-4-methyl-, dibromide, 4-(3-isoquinolin-2-ium-2-ylpropyl)-4-methylmorpholin-4-ium dibromide, 2-[3-(4-Methylmorpholin-4-ium-4-yl)propyl]isoquinolin-2-ium dibromide
| Molecular Formula | C17H24Br2N2O |
|---|---|
| Molecular Weight | 430.03 g/mol |
| LogP | -4.0 |
| Topological Polar Surface Area | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 432.0235 |
| Heavy Atoms | 22 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 64059-44-5 |
|---|---|
| SMILES | C[N+]1(CCOCC1)CCC[N+]2=CC3=CC=CC=C3C=C2.[Br-].[Br-] |
| InChIKey | SVSWMJWPWQDOBP-UHFFFAOYSA-L |
Product Overview
Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide (CAS 64059-44-5), with molecular formula C17H24Br2N2O and molecular weight 430.03 g/mol. IUPAC: 4-(3-isoquinolin-2-ium-2-ylpropyl)-4-methylmorpholin-4-ium dibromide.
Chemical Property Profile of Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide
Property Insights of Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide
The XLogP value of -4.0 indicates that Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 13.1 Ų, Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide 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 Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide?
The CAS number of Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide is 64059-44-5.
What is the molecular formula of Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide?
The molecular formula of Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide is C17H24Br2N2O.
What is the molecular weight of Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide?
The molecular weight of Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide is 430.03 g/mol.
Where can I buy Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide?
You can request a quote for Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide?
Yes, KEHONG BIO provides custom synthesis services for Isoquinolinium, 2-(3-(4-methylmorpholino)propyl)-, dibromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.