RefChem:357879
TL;DR: RefChem:357879 (CAS 2001-68-5) is a chemical compound with molecular formula C20H38Br2N4O4 and molecular weight 556.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methylmorpholin-4-ium-4-yl)-1-[4-[3-(4-methylmorpholin-4-ium-4-yl)propanoyl]piperazin-1-yl]propan-1-one dibromide
Also Known As: Morpholinium, 4,4'-(1,4-piperazinediylbis(carbonylethylene))bis(4-methyl-, dibromide, 4,4'-(1,4-Piperazinediylbis(carbonylethylene))bis(4-methylmorpholinium bromide), 3-(4-methylmorpholin-4-ium-4-yl)-1-[4-[3-(4-methylmorpholin-4-ium-4-yl)propanoyl]piperazin-1-yl]propan-1-one dibromide, 4,4'-[piperazine-1,4-diylbis(3-oxopropane-3,1-diyl)]bis(4-methylmorpholin-4-ium) dibromide, RefChem:357879
| Molecular Formula | C20H38Br2N4O4 |
|---|---|
| Molecular Weight | 556.13 g/mol |
| LogP | -6.6 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 558.1239 |
| Heavy Atoms | 30 |
| Complexity | 488.0 |
Chemical Identifiers
| CAS Number | 2001-68-5 |
|---|---|
| SMILES | C[N+]1(CCOCC1)CCC(=O)N2CCN(CC2)C(=O)CC[N+]3(CCOCC3)C.[Br-].[Br-] |
| InChIKey | XVLYYLUDCPBERS-UHFFFAOYSA-L |
Product Overview
RefChem:357879 (CAS 2001-68-5), with molecular formula C20H38Br2N4O4 and molecular weight 556.13 g/mol. IUPAC: 3-(4-methylmorpholin-4-ium-4-yl)-1-[4-[3-(4-methylmorpholin-4-ium-4-yl)propanoyl]piperazin-1-yl]propan-1-one dibromide.
Chemical Property Profile of RefChem:357879
Property Insights of RefChem:357879
The XLogP value of -6.6 indicates that RefChem:357879 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 59.1 Ų, RefChem:357879 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:357879 has 0 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:357879?
The CAS number of RefChem:357879 is 2001-68-5.
What is the molecular formula of RefChem:357879?
The molecular formula of RefChem:357879 is C20H38Br2N4O4.
What is the molecular weight of RefChem:357879?
The molecular weight of RefChem:357879 is 556.13 g/mol.
Where can I buy RefChem:357879?
You can request a quote for RefChem:357879 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:357879?
Yes, KEHONG BIO provides custom synthesis services for RefChem:357879 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.