F3060-0414
TL;DR: F3060-0414 (CAS 861124-54-1) is a chemical compound with molecular formula C22H19F3N4O2S and molecular weight 460.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[(5E)-4-oxo-5-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1,3-thiazol-2-yl]piperazin-1-yl]propanenitrile
Also Known As: F3060-0414, (E)-3-(4-(4-oxo-5-((5-(3-(trifluoromethyl)phenyl)furan-2-yl)methylene)-4,5-dihydrothiazol-2-yl)piperazin-1-yl)propanenitrile, 3-{4-[(5E)-4-oxo-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-4,5-dihydro-1,3-thiazol-2-yl]piperazin-1-yl}propanenitrile, 3-[4-[(5E)-4-oxo-5-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1,3-thiazol-2-yl]piperazin-1-yl]propanenitrile, 3-{4-[(E)-4-oxo-5-({5-[m-(trifluoromethyl)phenyl]-2-furyl}methylene)-4,5-dihydro-1,3-thiazol-2-yl]-1-piperazinyl}propiononitrile
| Molecular Formula | C22H19F3N4O2S |
|---|---|
| Molecular Weight | 460.12 g/mol |
| LogP | 4.46698 |
| Topological Polar Surface Area | 72.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 460.11807 |
| Heavy Atoms | 32 |
| Complexity | 1108.8646 |
Chemical Identifiers
| CAS Number | 861124-54-1 |
|---|---|
| SMILES | C1CN(CCN1CCC#N)C2=NC(=O)/C(=C\C3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F)/S2 |
Product Overview
F3060-0414 (CAS 861124-54-1), with molecular formula C22H19F3N4O2S and molecular weight 460.12 g/mol. IUPAC: 3-[4-[(5E)-4-oxo-5-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1,3-thiazol-2-yl]piperazin-1-yl]propanenitrile.
Chemical Property Profile of F3060-0414
Property Insights of F3060-0414
The XLogP value of 4.46698 indicates that F3060-0414 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.84 Ų falls within the moderate polarity range, balancing permeability and solubility for F3060-0414. Following Lipinski's Rule of Five, F3060-0414 has 0 hydrogen bond donor(s) and 6 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 F3060-0414?
The CAS number of F3060-0414 is 861124-54-1.
What is the molecular formula of F3060-0414?
The molecular formula of F3060-0414 is C22H19F3N4O2S.
What is the molecular weight of F3060-0414?
The molecular weight of F3060-0414 is 460.12 g/mol.
Where can I buy F3060-0414?
You can request a quote for F3060-0414 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F3060-0414?
Yes, KEHONG BIO provides custom synthesis services for F3060-0414 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.