![(E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one structure](/static/products/116/1164451-93-7.png)
(E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one
TL;DR: (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one (CAS 1164451-93-7) is a chemical compound with molecular formula C14H16F4N2O2 and molecular weight 320.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one
Also Known As: (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one, (3E)-4-[(2-{[2,3,5,6-tetrafluoro-4-(hydroxymethyl)phenyl]amino}ethyl)amino]pent-3-en-2-one, (E)-4-((2-((2,3,5,6-tetrafluoro-4-(hydroxymethyl)phenyl)amino)ethyl)amino)pent-3-en-2-one
| Molecular Formula | C14H16F4N2O2 |
|---|---|
| Molecular Weight | 320.11 g/mol |
| LogP | 2.2296 |
| Topological Polar Surface Area | 61.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 320.11478 |
| Heavy Atoms | 22 |
| Complexity | 573.991 |
Chemical Identifiers
| CAS Number | 1164451-93-7 |
|---|---|
| SMILES | C/C(=C\C(=O)C)/NCCNC1=C(C(=C(C(=C1F)F)CO)F)F |
Product Overview
(E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one (CAS 1164451-93-7), with molecular formula C14H16F4N2O2 and molecular weight 320.11 g/mol. IUPAC: (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one.
Chemical Property Profile of (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one
Property Insights of (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one
The XLogP value of 2.2296 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one. The TPSA of 61.36 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one. Following Lipinski's Rule of Five, (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one has 3 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 (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one?
The CAS number of (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one is 1164451-93-7.
What is the molecular formula of (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one?
The molecular formula of (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one is C14H16F4N2O2.
What is the molecular weight of (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one?
The molecular weight of (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one is 320.11 g/mol.
Where can I buy (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one?
You can request a quote for (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-[2-[2,3,5,6-tetrafluoro-4-(hydroxymethyl)anilino]ethylamino]pent-3-en-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.