![1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine structure](/static/products/4745/47453-14-5.webp)
1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine
TL;DR: 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine (CAS 47453-14-5) is a chemical compound with molecular formula C23H31NS and molecular weight 353.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[5-(2,2-dimethylpropyl)thiophen-2-yl]-4-phenylbut-3-enyl]pyrrolidine
Also Known As: 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine
| Molecular Formula | C23H31NS |
|---|---|
| Molecular Weight | 353.22 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 31.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 353.2177 |
| Heavy Atoms | 25 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 47453-14-5 |
|---|---|
| SMILES | CC(C)(C)CC1=CC=C(S1)C(=CCCN2CCCC2)C3=CC=CC=C3 |
| InChIKey | HZZXGWBOCXDVLV-UHFFFAOYSA-N |
Product Overview
1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine (CAS 47453-14-5), with molecular formula C23H31NS and molecular weight 353.22 g/mol. IUPAC: 1-[4-[5-(2,2-dimethylpropyl)thiophen-2-yl]-4-phenylbut-3-enyl]pyrrolidine.
Chemical Property Profile of 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine
Property Insights of 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine
The XLogP value of 7.0 indicates that 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.5 Ų, 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine?
The CAS number of 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine is 47453-14-5.
What is the molecular formula of 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine?
The molecular formula of 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine is C23H31NS.
What is the molecular weight of 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine?
The molecular weight of 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine is 353.22 g/mol.
Where can I buy 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine?
You can request a quote for 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(Z)-4-[5-(2,2-Dimethylpropyl)-2-thienyl]-4-phenyl-3-butenyl]pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.