3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl-
TL;DR: 3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl- (CAS 57734-76-6) is a chemical compound with molecular formula C16H19NOS2 and molecular weight 305.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-azabicyclo[2.2.2]octan-3-yl(dithiophen-2-yl)methanol
Also Known As: Quiditene, Quiditene base, Quinuclidin-3-yldi(thiophen-2-yl)methanol, 1-azabicyclo[2.2.2]oct-3-yl(di-2-thienyl)methanol, TimTec1_003873
| Molecular Formula | C16H19NOS2 |
|---|---|
| Molecular Weight | 305.09 g/mol |
| LogP | 3.3873 |
| Topological Polar Surface Area | 23.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.09082 |
| Heavy Atoms | 20 |
| Complexity | 521.0809 |
Chemical Identifiers
| CAS Number | 57734-76-6 |
|---|---|
| SMILES | C1CN2CCC1C(C2)C(C3=CC=CS3)(C4=CC=CS4)O |
Product Overview
3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl- (CAS 57734-76-6), with molecular formula C16H19NOS2 and molecular weight 305.09 g/mol. IUPAC: 1-azabicyclo[2.2.2]octan-3-yl(dithiophen-2-yl)methanol.
Chemical Property Profile of 3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl-
Property Insights of 3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl-
The XLogP value of 3.3873 indicates that 3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.47 Ų, 3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl- has 1 hydrogen bond donor(s) and 4 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-Quinuclidinemethanol, alpha,alpha-di-2-thienyl-?
The CAS number of 3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl- is 57734-76-6.
What is the molecular formula of 3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl-?
The molecular formula of 3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl- is C16H19NOS2.
What is the molecular weight of 3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl-?
The molecular weight of 3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl- is 305.09 g/mol.
Where can I buy 3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl-?
You can request a quote for 3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Quinuclidinemethanol, alpha,alpha-di-2-thienyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.