(Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one
TL;DR: (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one (CAS 538338-92-0) is a chemical compound with molecular formula C14H14FNO2 and molecular weight 247.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-2-tert-butyl-4-[(2-fluorophenyl)methylidene]-1,3-oxazol-5-one
Also Known As: F1258-0033, (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one, (4Z)-2-tert-butyl-4-[(2-fluorophenyl)methylidene]-1,3-oxazol-5-one, (4Z)-2-tert-butyl-4-[(2-fluorophenyl)methylidene]-4,5-dihydro-1,3-oxazol-5-one, 2-(tert-Butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one
| Molecular Formula | C14H14FNO2 |
|---|---|
| Molecular Weight | 247.10 g/mol |
| LogP | 3.168 |
| Topological Polar Surface Area | 38.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 247.10086 |
| Heavy Atoms | 18 |
| Complexity | 553.1576 |
Chemical Identifiers
| CAS Number | 538338-92-0 |
|---|---|
| SMILES | CC(C)(C)C1=N/C(=C\C2=CC=CC=C2F)/C(=O)O1 |
Product Overview
(Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one (CAS 538338-92-0), with molecular formula C14H14FNO2 and molecular weight 247.10 g/mol. IUPAC: (4Z)-2-tert-butyl-4-[(2-fluorophenyl)methylidene]-1,3-oxazol-5-one.
Chemical Property Profile of (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one
Property Insights of (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one
The XLogP value of 3.168 indicates that (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.66 Ų, (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one has 0 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 (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one?
The CAS number of (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one is 538338-92-0.
What is the molecular formula of (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one?
The molecular formula of (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one is C14H14FNO2.
What is the molecular weight of (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one?
The molecular weight of (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one is 247.10 g/mol.
Where can I buy (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one?
You can request a quote for (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-2-(tert-butyl)-4-(2-fluorobenzylidene)oxazol-5(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.