RefChem:319104
TL;DR: RefChem:319104 (CAS 101710-68-3) is a chemical compound with molecular formula C36H46Br2N2O4 and molecular weight 728.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[4-[4-[4-[2-[dimethyl(4-oxopentyl)azaniumyl]acetyl]phenyl]phenyl]phenyl]-2-oxoethyl]-dimethyl-(4-oxopentyl)azanium dibromide
Also Known As: Ammonium, (p-terphenyl-4,4''-ylene)bis(2-oxoethylene)bis((3-acetylpropyl)dimethyl-, dibromide, (4,4''-(1,1':4',1''-Terphenylylene))bis(2-oxoethylene)bis(4-oxopentyldimethylammoniumbromide), (p-Terphenyl-4,4''-ylene)bis(2-oxoethylene)bis((3-acetylpropyl)dimethylammoniumbromide), [2-[4-[4-[4-[2-[dimethyl(4-oxopentyl)azaniumyl]acetyl]phenyl]phenyl]phenyl]-2-oxoethyl]-dimethyl-(4-oxopentyl)azanium dibromide, N,N'-[[1~1~,2~1~:2~4~,3~1~-Terphenyl]-1~4~,3~4~-diylbis(2-oxoethane-2,1-diyl)]bis(N,N-dimethyl-4-oxopentan-1-aminium) dibromide
| Molecular Formula | C36H46Br2N2O4 |
|---|---|
| Molecular Weight | 728.18 g/mol |
| LogP | 0.2852 |
| Topological Polar Surface Area | 68.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 16 |
| Exact Mass | 728.18243 |
| Heavy Atoms | 44 |
| Complexity | 1289.0583 |
Chemical Identifiers
| CAS Number | 101710-68-3 |
|---|---|
| SMILES | CC(=O)CCC[N+](C)(C)CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)C[N+](C)(C)CCCC(=O)C.[Br-].[Br-] |
Product Overview
RefChem:319104 (CAS 101710-68-3), with molecular formula C36H46Br2N2O4 and molecular weight 728.18 g/mol. IUPAC: [2-[4-[4-[4-[2-[dimethyl(4-oxopentyl)azaniumyl]acetyl]phenyl]phenyl]phenyl]-2-oxoethyl]-dimethyl-(4-oxopentyl)azanium dibromide.
Chemical Property Profile of RefChem:319104
Property Insights of RefChem:319104
The XLogP value of 0.2852 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:319104. The TPSA of 68.28 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:319104. Following Lipinski's Rule of Five, RefChem:319104 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:319104?
The CAS number of RefChem:319104 is 101710-68-3.
What is the molecular formula of RefChem:319104?
The molecular formula of RefChem:319104 is C36H46Br2N2O4.
What is the molecular weight of RefChem:319104?
The molecular weight of RefChem:319104 is 728.18 g/mol.
Where can I buy RefChem:319104?
You can request a quote for RefChem:319104 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:319104?
Yes, KEHONG BIO provides custom synthesis services for RefChem:319104 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.