![2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one structure](/static/products/7066/7066-68-4.webp)
2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
TL;DR: 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one (CAS 7066-68-4) is a chemical compound with molecular formula C26H26ClN3O3S and molecular weight 495.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-chlorophenyl)ethenyl]-5-[(4-hexoxy-3-methoxyphenyl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
Also Known As: 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one, 2-[2-(4-Chlorophenyl)ethen-1-yl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one, 2-[2-(4-chlorophenyl)ethenyl]-5-[(4-hexoxy-3-methoxyphenyl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
| Molecular Formula | C26H26ClN3O3S |
|---|---|
| Molecular Weight | 495.14 g/mol |
| LogP | 5.4902 |
| Topological Polar Surface Area | 65.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 495.13834 |
| Heavy Atoms | 34 |
| Complexity | 1393.4276 |
Chemical Identifiers
| CAS Number | 7066-68-4 |
|---|---|
| SMILES | CCCCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C=CC4=CC=C(C=C4)Cl)S2)OC |
Product Overview
2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one (CAS 7066-68-4), with molecular formula C26H26ClN3O3S and molecular weight 495.14 g/mol. IUPAC: 2-[2-(4-chlorophenyl)ethenyl]-5-[(4-hexoxy-3-methoxyphenyl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one.
Chemical Property Profile of 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Property Insights of 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
The XLogP value of 5.4902 indicates that 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one. Following Lipinski's Rule of Five, 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one?
The CAS number of 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one is 7066-68-4.
What is the molecular formula of 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one?
The molecular formula of 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one is C26H26ClN3O3S.
What is the molecular weight of 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one?
The molecular weight of 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one is 495.14 g/mol.
Where can I buy 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one?
You can request a quote for 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(4-Chlorophenyl)ethenyl]-5-{[4-(hexyloxy)-3-methoxyphenyl]methylidene}[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.