(3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium
TL;DR: (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium (CAS 935693-62-2) is a chemical compound with molecular formula C16H22NOS+ and molecular weight 276.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium
Also Known As: BIX01294 Hydrochloride, (3-hydroxy-3-phenyl-3-thiophen-2-yl-propyl)-trimethyl-azanium, (3-hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium
| Molecular Formula | C16H22NOS+ |
|---|---|
| Molecular Weight | 276.14 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 48.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 276.1422 |
| Heavy Atoms | 19 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 935693-62-2 |
|---|---|
| SMILES | C[N+](C)(C)CCC(C1=CC=CC=C1)(C2=CC=CS2)O |
| InChIKey | AENQBVNYZBBBFF-UHFFFAOYSA-N |
Product Overview
(3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium (CAS 935693-62-2), with molecular formula C16H22NOS+ and molecular weight 276.14 g/mol. IUPAC: (3-hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium.
Chemical Property Profile of (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium
Property Insights of (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium. With a topological polar surface area (TPSA) of 48.5 Ų, (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium has 1 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 (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium?
The CAS number of (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium is 935693-62-2.
What is the molecular formula of (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium?
The molecular formula of (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium is C16H22NOS+.
What is the molecular weight of (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium?
The molecular weight of (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium is 276.14 g/mol.
Where can I buy (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium?
You can request a quote for (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium?
Yes, KEHONG BIO provides custom synthesis services for (3-Hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.