4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide
TL;DR: 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide (CAS 2110-33-0) is a chemical compound with molecular formula C18H21BrN2O and molecular weight 360.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-hydroxy-4-phenyl-4-pyridin-2-ylbut-2-ynyl)-trimethylazanium bromide
Also Known As: (4-Hydroxy-4-phenyl-4-(2-pyridyl)-2-butynyl)trimethylammonium bromide, (4-hydroxy-4-phenyl-4-pyridin-2-ylbut-2-ynyl)-trimethylazanium bromide, 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide, AMMONIUM, (4-HYDROXY-4-PHENYL-4-(2-PYRIDYL)-2-BUTYNYL)TRIMETHYL-, BROMIDE, (4-hydroxy-4-phenyl-4-pyridin-2-ylbut-2-ynyl)-trimethylazanium,bromide
| Molecular Formula | C18H21BrN2O |
|---|---|
| Molecular Weight | 360.08 g/mol |
| LogP | -0.97 |
| Topological Polar Surface Area | 33.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 360.08374 |
| Heavy Atoms | 22 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 2110-33-0 |
|---|---|
| SMILES | C[N+](C)(C)CC#CC(C1=CC=CC=C1)(C2=CC=CC=N2)O.[Br-] |
| InChIKey | ITUWZGNLDNDFGV-UHFFFAOYSA-M |
Product Overview
4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide (CAS 2110-33-0), with molecular formula C18H21BrN2O and molecular weight 360.08 g/mol. IUPAC: (4-hydroxy-4-phenyl-4-pyridin-2-ylbut-2-ynyl)-trimethylazanium bromide.
Chemical Property Profile of 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide
Property Insights of 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide
The XLogP value of -0.97 indicates that 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 33.1 Ų, 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide 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
Frequently Asked Questions
What is the CAS number of 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide?
The CAS number of 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide is 2110-33-0.
What is the molecular formula of 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide?
The molecular formula of 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide is C18H21BrN2O.
What is the molecular weight of 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide?
The molecular weight of 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide is 360.08 g/mol.
Where can I buy 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide?
You can request a quote for 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-N,N,N-trimethyl-4-phenyl-4-(pyridin-2-yl)but-2-yn-1-aminium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.