(Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate
TL;DR: (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate (CAS 575462-83-8) is a chemical compound with molecular formula C19H12FN3O3S and molecular weight 381.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[(Z)-[2-(4-fluorophenyl)-6-oxo-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-ylidene]methyl]phenyl] acetate
Also Known As: (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate, [3-[(Z)-[2-(4-fluorophenyl)-6-oxo-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-ylidene]methyl]phenyl] acetate, 3-{[(5Z)-2-(4-FLUOROPHENYL)-6-OXO-5H,6H-[1,2,4]TRIAZOLO[3,2-B][1,3]THIAZOL-5-YLIDENE]METHYL}PHENYL ACETATE
| Molecular Formula | C19H12FN3O3S |
|---|---|
| Molecular Weight | 381.06 g/mol |
| LogP | 2.4301 |
| Topological Polar Surface Area | 73.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 381.05835 |
| Heavy Atoms | 27 |
| Complexity | 1261.8348 |
Chemical Identifiers
| CAS Number | 575462-83-8 |
|---|---|
| SMILES | CC(=O)OC1=CC=CC(=C1)/C=C\2/C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)F)S2 |
Product Overview
(Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate (CAS 575462-83-8), with molecular formula C19H12FN3O3S and molecular weight 381.06 g/mol. IUPAC: [3-[(Z)-[2-(4-fluorophenyl)-6-oxo-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-ylidene]methyl]phenyl] acetate.
Chemical Property Profile of (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate
Property Insights of (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate
The XLogP value of 2.4301 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate. The TPSA of 73.56 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate. Following Lipinski's Rule of Five, (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate 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 (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate?
The CAS number of (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate is 575462-83-8.
What is the molecular formula of (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate?
The molecular formula of (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate is C19H12FN3O3S.
What is the molecular weight of (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate?
The molecular weight of (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate is 381.06 g/mol.
Where can I buy (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate?
You can request a quote for (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-((2-(4-fluorophenyl)-6-oxothiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene)methyl)phenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.