1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate
TL;DR: 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate (CAS 141433-62-7) is a chemical compound with molecular formula C24H24Cl2N2O and molecular weight 426.12656 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzyl-4-(1-benzylpyridin-1-ium-4-yl)pyridin-1-ium;dichloride;hydrate
Also Known As: 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate, 6690AF, 4,4'-Bipyridinium, 1,1'-bis(phenylmethyl)-, dichloride, monohydrate, 1,1'-Bis(phenylmethyl)-4,4'-bipyridinium dichloride monohydate, 1,1'-Dibenzyl-[4,4'-bipyridine]-1,1'-diium chloride hydrate
Technical Specifications
| Molecular Formula | C24H24Cl2N2O |
| Molecular Weight | 426.12656 g/mol |
| XLogP | -2.7915 |
| Topological Polar Surface Area (TPSA) | 8.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 426.12656 Da |
| Heavy Atoms | 29 |
| Complexity | 343.0 |
| SMILES | C1=CC=C(C=C1)C[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)CC4=CC=CC=C4.O.[Cl-].[Cl-] |
| InChIKey | DOWRDMMCSCRNJC-UHFFFAOYSA-L |
Chemical Property Profile of 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate
Property Insights of 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate
The XLogP value of -2.7915 indicates that 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 8.8 Ų, 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate?
The CAS number of 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate is 141433-62-7.
What is the molecular formula of 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate?
The molecular formula of 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate is C24H24Cl2N2O.
What is the molecular weight of 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate?
The molecular weight of 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate is 426.12656 g/mol.
Where can I buy 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate?
You can request a quote for 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate?
Yes, CoreyChem provides custom synthesis services for 1,1'-Dibenzyl-4,4'-bipyridiniuM Dichloride Hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.