![(5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one structure](/static/products/797/797764-35-3.png)
(5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
TL;DR: (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one (CAS 797764-35-3) is a chemical compound with molecular formula C29H31N3O4S and molecular weight 517.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
Also Known As: (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one, (5E)-5-[3-methoxy-4-(octyloxy)benzylidene]-2-(3-methyl-1-benzofuran-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one, (E)-5-(3-methoxy-4-(octyloxy)benzylidene)-2-(3-methylbenzofuran-2-yl)thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
| Molecular Formula | C29H31N3O4S |
|---|---|
| Molecular Weight | 517.20 g/mol |
| LogP | 6.16822 |
| Topological Polar Surface Area | 78.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 517.20355 |
| Heavy Atoms | 37 |
| Complexity | 1632.4218 |
Chemical Identifiers
| CAS Number | 797764-35-3 |
|---|---|
| SMILES | CCCCCCCCOC1=C(C=C(C=C1)/C=C/2\C(=O)N3C(=NC(=N3)C4=C(C5=CC=CC=C5O4)C)S2)OC |
Product Overview
(5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one (CAS 797764-35-3), with molecular formula C29H31N3O4S and molecular weight 517.20 g/mol. IUPAC: (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one.
Chemical Property Profile of (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
Property Insights of (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
The XLogP value of 6.16822 indicates that (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.86 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one. Following Lipinski's Rule of Five, (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one?
The CAS number of (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one is 797764-35-3.
What is the molecular formula of (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one?
The molecular formula of (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one is C29H31N3O4S.
What is the molecular weight of (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one?
The molecular weight of (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one is 517.20 g/mol.
Where can I buy (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one?
You can request a quote for (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one?
Yes, KEHONG BIO provides custom synthesis services for (5E)-5-[(3-methoxy-4-octoxyphenyl)methylidene]-2-(3-methyl-1-benzofuran-2-yl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.