RefChem:1076819
TL;DR: RefChem:1076819 (CAS 2748-49-4) is a chemical compound with molecular formula C24H46Br2N4O2 and molecular weight 580.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[3,6-dioxo-4-[3-(triethylazaniumyl)propylamino]cyclohexa-1,4-dien-1-yl]amino]propyl-triethylazanium dibromide
Also Known As: Ammonium, (p-benzoquinon-2,5-ylenebis(iminotrimethylene))bis(triethyl-, dibromide, Benzoquinone, 2,5-bis(3-diethylaminopropylamino), bis-ethobromide, 1-Propanaminium, 3,3'-((3,6-dioxo-1,4-cyclohexadiene-1,4-diyl)diimino)bis(N,N,N-triethyl-, dibromide, 1-Propanaminium,3,3'-[(3,6-dioxo-1,4-cyclohexadiene-1,4-diyl, Ammonium, (p-benzoquinone-2,5-ylenebis(iminotrimethylene))bis(triethyl-, dibromide
| Molecular Formula | C24H46Br2N4O2 |
|---|---|
| Molecular Weight | 580.20 g/mol |
| LogP | -3.37 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 16 |
| Exact Mass | 582.1967 |
| Heavy Atoms | 32 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 2748-49-4 |
|---|---|
| SMILES | CC[N+](CC)(CC)CCCNC1=CC(=O)C(=CC1=O)NCCC[N+](CC)(CC)CC.[Br-].[Br-] |
| InChIKey | ZRVNRCFIHSGINB-UHFFFAOYSA-N |
Product Overview
RefChem:1076819 (CAS 2748-49-4), with molecular formula C24H46Br2N4O2 and molecular weight 580.20 g/mol. IUPAC: 3-[[3,6-dioxo-4-[3-(triethylazaniumyl)propylamino]cyclohexa-1,4-dien-1-yl]amino]propyl-triethylazanium dibromide.
Chemical Property Profile of RefChem:1076819
Property Insights of RefChem:1076819
The XLogP value of -3.37 indicates that RefChem:1076819 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.2 Ų, RefChem:1076819 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1076819 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1076819?
The CAS number of RefChem:1076819 is 2748-49-4.
What is the molecular formula of RefChem:1076819?
The molecular formula of RefChem:1076819 is C24H46Br2N4O2.
What is the molecular weight of RefChem:1076819?
The molecular weight of RefChem:1076819 is 580.20 g/mol.
Where can I buy RefChem:1076819?
You can request a quote for RefChem:1076819 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1076819?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1076819 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.