Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)-
TL;DR: Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)- (CAS 36702-83-7) is a chemical compound with molecular formula C20H21NOS2 and molecular weight 355.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3,3-di(thiophen-3-yl)prop-2-enylamino]-1-phenylpropan-1-ol
Also Known As: Tinofedrine, Novocebrin, Tinofedrin, D 8955, (1-(3,3-Di(thien-3-ylallyl)amino)ethyl)benzyl alcohol
| Molecular Formula | C20H21NOS2 |
|---|---|
| Molecular Weight | 355.11 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 88.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 355.10645 |
| Heavy Atoms | 24 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 36702-83-7 |
|---|---|
| SMILES | CC(C(C1=CC=CC=C1)O)NCC=C(C2=CSC=C2)C3=CSC=C3 |
| InChIKey | JQSHEDRVRBSFCZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)- (CAS 36702-83-7), with molecular formula C20H21NOS2 and molecular weight 355.11 g/mol. IUPAC: 2-[3,3-di(thiophen-3-yl)prop-2-enylamino]-1-phenylpropan-1-ol.
Chemical Property Profile of Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)-
Property Insights of Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)-
The XLogP value of 4.5 indicates that Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)-. Following Lipinski's Rule of Five, Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)- has 2 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 Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)-?
The CAS number of Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)- is 36702-83-7.
What is the molecular formula of Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)-?
The molecular formula of Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)- is C20H21NOS2.
What is the molecular weight of Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)-?
The molecular weight of Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)- is 355.11 g/mol.
Where can I buy Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)-?
You can request a quote for Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanol, alpha-(1-((3,3-di-3-thienyl-2-propenyl)amino)ethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.