2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)-
TL;DR: 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)- (CAS 76691-07-1) is a chemical compound with molecular formula C19H20FNO2 and molecular weight 313.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-1-(3-fluorophenyl)-3-[2-(4-methoxyphenyl)ethylamino]but-2-en-1-one
Also Known As: 1-(3-Fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)-2-buten-1-one, 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)-, (Z)-1-(3-fluorophenyl)-3-[2-(4-methoxyphenyl)ethylamino]but-2-en-1-one, RefChem:1062542
| Molecular Formula | C19H20FNO2 |
|---|---|
| Molecular Weight | 313.15 g/mol |
| LogP | 3.7531 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 313.1478 |
| Heavy Atoms | 23 |
| Complexity | 692.77075 |
Chemical Identifiers
| CAS Number | 76691-07-1 |
|---|---|
| SMILES | C/C(=C/C(=O)C1=CC(=CC=C1)F)/NCCC2=CC=C(C=C2)OC |
Product Overview
2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)- (CAS 76691-07-1), with molecular formula C19H20FNO2 and molecular weight 313.15 g/mol. IUPAC: (Z)-1-(3-fluorophenyl)-3-[2-(4-methoxyphenyl)ethylamino]but-2-en-1-one.
Chemical Property Profile of 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)-
Property Insights of 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)-
The XLogP value of 3.7531 indicates that 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)- has 1 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 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)-?
The CAS number of 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)- is 76691-07-1.
What is the molecular formula of 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)-?
The molecular formula of 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)- is C19H20FNO2.
What is the molecular weight of 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)-?
The molecular weight of 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)- is 313.15 g/mol.
Where can I buy 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)-?
You can request a quote for 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Buten-1-one, 1-(3-fluorophenyl)-3-((2-(4-methoxyphenyl)ethyl)amino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.