Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide
TL;DR: Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide (CAS 70919-95-8) is a chemical compound with molecular formula C24H27BrN6O6 and molecular weight 574.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl]pyridin-1-ium-4-yl]-3,4,5-trimethoxybenzamide bromide
Also Known As: Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide, 1-(2-(1,3-DIMETHYL-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-7-YL)ETHYL)-4-((3,4,5-TRIMETHOXYBENZOYL) AMINO)PYRIDINIUM BROMIDE, N-[1-[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)ethyl]pyridin-4-yl]-3,4,5-trimethoxy-benzamide Bromide, N-[1-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl]pyridin-1-ium-4-yl]-3,4,5-trimethoxybenzamide bromide, RefChem:376984
| Molecular Formula | C24H27BrN6O6 |
|---|---|
| Molecular Weight | 574.12 g/mol |
| LogP | -2.2965 |
| Topological Polar Surface Area | 122.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 574.11755 |
| Heavy Atoms | 37 |
| Complexity | 1532.2249 |
Chemical Identifiers
| CAS Number | 70919-95-8 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC[N+]3=CC=C(C=C3)NC(=O)C4=CC(=C(C(=C4)OC)OC)OC.[Br-] |
Product Overview
Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide (CAS 70919-95-8), with molecular formula C24H27BrN6O6 and molecular weight 574.12 g/mol. IUPAC: N-[1-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl]pyridin-1-ium-4-yl]-3,4,5-trimethoxybenzamide bromide.
Chemical Property Profile of Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide
Property Insights of Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide
The XLogP value of -2.2965 indicates that Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 122.49 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide. Following Lipinski's Rule of Five, Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide?
The CAS number of Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide is 70919-95-8.
What is the molecular formula of Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide?
The molecular formula of Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide is C24H27BrN6O6.
What is the molecular weight of Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide?
The molecular weight of Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide is 574.12 g/mol.
Where can I buy Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide?
You can request a quote for Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide?
Yes, KEHONG BIO provides custom synthesis services for Pyridinium, 1-(2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl)-4-((3,4,5-trimethoxybenzoyl)amino)-, bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.