4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide
TL;DR: 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide (CAS 123489-63-4) is a chemical compound with molecular formula C28H38Br2N2O2 and molecular weight 592.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dimethylpyrrolidin-1-ium-1-yl)-1-[4-[4-[2-(1,3-dimethylpyrrolidin-1-ium-1-yl)acetyl]phenyl]phenyl]ethanone dibromide
Also Known As: 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide, Pyrrolidinium, 1,1'-((1,1'-biphenyl)-4,4'-diylbis(2-oxo-2,1-ethanediyl))bis(1,3-dimethyl-, dibromide, 4,4/'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide, 2-(1,3-dimethylpyrrolidin-1-ium-1-yl)-1-[4-[4-[2-(1,3-dimethylpyrrolidin-1-ium-1-yl)acetyl]phenyl]phenyl]ethanone;dibromide, 1,1'-[[1,1'-Biphenyl]-4,4'-diylbis(2-oxoethane-2,1-diyl)]bis(1,3-dimethylpyrrolidin-1-ium) dibromide
| Molecular Formula | C28H38Br2N2O2 |
|---|---|
| Molecular Weight | 592.13 g/mol |
| LogP | -1.3002 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 592.13 |
| Heavy Atoms | 34 |
| Complexity | 910.97064 |
Chemical Identifiers
| CAS Number | 123489-63-4 |
|---|---|
| SMILES | CC1CC[N+](C1)(C)CC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)C[N+]4(CCC(C4)C)C.[Br-].[Br-] |
Product Overview
4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide (CAS 123489-63-4), with molecular formula C28H38Br2N2O2 and molecular weight 592.13 g/mol. IUPAC: 2-(1,3-dimethylpyrrolidin-1-ium-1-yl)-1-[4-[4-[2-(1,3-dimethylpyrrolidin-1-ium-1-yl)acetyl]phenyl]phenyl]ethanone dibromide.
Chemical Property Profile of 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide
Property Insights of 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide
The XLogP value of -1.3002 indicates that 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 34.14 Ų, 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide?
The CAS number of 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide is 123489-63-4.
What is the molecular formula of 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide?
The molecular formula of 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide is C28H38Br2N2O2.
What is the molecular weight of 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide?
The molecular weight of 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide is 592.13 g/mol.
Where can I buy 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide?
You can request a quote for 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-Bis((3-methylpyrrolidino)acetyl)biphenyl dimethiobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.