(E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one
TL;DR: (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one (CAS 848932-05-8) is a chemical compound with molecular formula C21H18F3N3O3S and molecular weight 449.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-2-(4-acetylpiperazin-1-yl)-5-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1,3-thiazol-4-one
Also Known As: (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one, F3044-0415, (5E)-2-(4-acetylpiperazin-1-yl)-5-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1,3-thiazol-4-one, (5E)-2-(4-acetylpiperazin-1-yl)-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-4,5-dihydro-1,3-thiazol-4-one, (5E)-2-(4-acetylpiperazin-1-yl)-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-1,3-thiazol-4(5H)-one
| Molecular Formula | C21H18F3N3O3S |
|---|---|
| Molecular Weight | 449.10 g/mol |
| LogP | 4.0998 |
| Topological Polar Surface Area | 66.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 449.1021 |
| Heavy Atoms | 31 |
| Complexity | 1082.7794 |
Chemical Identifiers
| CAS Number | 848932-05-8 |
|---|---|
| SMILES | CC(=O)N1CCN(CC1)C2=NC(=O)/C(=C\C3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F)/S2 |
Product Overview
(E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one (CAS 848932-05-8), with molecular formula C21H18F3N3O3S and molecular weight 449.10 g/mol. IUPAC: (5E)-2-(4-acetylpiperazin-1-yl)-5-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1,3-thiazol-4-one.
Chemical Property Profile of (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one
Property Insights of (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one
The XLogP value of 4.0998 indicates that (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.12 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one. Following Lipinski's Rule of Five, (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one has 0 hydrogen bond donor(s) and 5 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)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one?
The CAS number of (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one is 848932-05-8.
What is the molecular formula of (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one?
The molecular formula of (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one is C21H18F3N3O3S.
What is the molecular weight of (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one?
The molecular weight of (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one is 449.10 g/mol.
Where can I buy (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one?
You can request a quote for (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(4-acetylpiperazin-1-yl)-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)thiazol-4(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.