Quinuclidine, 3-(di-2-thienylmethylene)-
TL;DR: Quinuclidine, 3-(di-2-thienylmethylene)- (CAS 60698-05-7) is a chemical compound with molecular formula C16H17NS2 and molecular weight 287.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dithiophen-2-ylmethylidene)-1-azabicyclo[2.2.2]octane
Also Known As: 3-(Di-2-thienylmethylene)quinuclidine, Quinuclidine, 3-(di-2-thienylmethylene)-, 3-(dithiophen-2-ylmethylidene)-1-azabicyclo[2.2.2]octane, 3-[bis(thiophen-2-yl)methylidene]-1-azabicyclo[2.2.2]octane, 3-[Di(thiophen-2-yl)methylidene]-1-azabicyclo[2.2.2]octane
| Molecular Formula | C16H17NS2 |
|---|---|
| Molecular Weight | 287.08 g/mol |
| LogP | 4.3371 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.08023 |
| Heavy Atoms | 19 |
| Complexity | 536.06226 |
Chemical Identifiers
| CAS Number | 60698-05-7 |
|---|---|
| SMILES | C1CN2CCC1C(=C(C3=CC=CS3)C4=CC=CS4)C2 |
Product Overview
Quinuclidine, 3-(di-2-thienylmethylene)- (CAS 60698-05-7), with molecular formula C16H17NS2 and molecular weight 287.08 g/mol. IUPAC: 3-(dithiophen-2-ylmethylidene)-1-azabicyclo[2.2.2]octane.
Chemical Property Profile of Quinuclidine, 3-(di-2-thienylmethylene)-
Property Insights of Quinuclidine, 3-(di-2-thienylmethylene)-
The XLogP value of 4.3371 indicates that Quinuclidine, 3-(di-2-thienylmethylene)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, Quinuclidine, 3-(di-2-thienylmethylene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinuclidine, 3-(di-2-thienylmethylene)- has 0 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 Quinuclidine, 3-(di-2-thienylmethylene)-?
The CAS number of Quinuclidine, 3-(di-2-thienylmethylene)- is 60698-05-7.
What is the molecular formula of Quinuclidine, 3-(di-2-thienylmethylene)-?
The molecular formula of Quinuclidine, 3-(di-2-thienylmethylene)- is C16H17NS2.
What is the molecular weight of Quinuclidine, 3-(di-2-thienylmethylene)-?
The molecular weight of Quinuclidine, 3-(di-2-thienylmethylene)- is 287.08 g/mol.
Where can I buy Quinuclidine, 3-(di-2-thienylmethylene)-?
You can request a quote for Quinuclidine, 3-(di-2-thienylmethylene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinuclidine, 3-(di-2-thienylmethylene)-?
Yes, KEHONG BIO provides custom synthesis services for Quinuclidine, 3-(di-2-thienylmethylene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.