Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide
TL;DR: Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide (CAS 81439-98-7) is a chemical compound with molecular formula C14H17BrN2 and molecular weight 292.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-N,N-dimethylpyridin-1-ium-4-amine bromide
Also Known As: 1-Benzyl-4-dimethylamino-pyridinium, Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide, 1-BENZYL-4-(DIMETHYLAMINO)PYRIDIN-1-IUM BROMIDE, 1-benzyl-N,N-dimethylpyridin-1-ium-4-amine bromide, 1-benzyl-N,N-dimethylpyridin-1-ium-4-amine,bromide
| Molecular Formula | C14H17BrN2 |
|---|---|
| Molecular Weight | 292.06 g/mol |
| LogP | -0.9076 |
| Topological Polar Surface Area | 7.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.0575 |
| Heavy Atoms | 17 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 81439-98-7 |
|---|---|
| SMILES | CN(C)C1=CC=[N+](C=C1)CC2=CC=CC=C2.[Br-] |
| InChIKey | DLQQZLHDSORQJZ-UHFFFAOYSA-M |
Product Overview
Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide (CAS 81439-98-7), with molecular formula C14H17BrN2 and molecular weight 292.06 g/mol. IUPAC: 1-benzyl-N,N-dimethylpyridin-1-ium-4-amine bromide.
Chemical Property Profile of Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide
Property Insights of Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide
The XLogP value of -0.9076 indicates that Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 7.1 Ų, Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide?
The CAS number of Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide is 81439-98-7.
What is the molecular formula of Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide?
The molecular formula of Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide is C14H17BrN2.
What is the molecular weight of Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide?
The molecular weight of Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide is 292.06 g/mol.
Where can I buy Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide?
You can request a quote for Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide?
Yes, KEHONG BIO provides custom synthesis services for Pyridinium, 4-(dimethylamino)-1-(phenylmethyl)-, bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.