(E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one
TL;DR: (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one (CAS 575470-55-2) is a chemical compound with molecular formula C25H19N3O3S and molecular weight 441.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6E)-6-[(3-methoxy-4-phenylmethoxyphenyl)methylidene]-3-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one
Also Known As: (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one, (6E)-6-[(3-methoxy-4-phenylmethoxyphenyl)methylidene]-3-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one
| Molecular Formula | C25H19N3O3S |
|---|---|
| Molecular Weight | 441.11 g/mol |
| LogP | 3.9533 |
| Topological Polar Surface Area | 65.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 441.11472 |
| Heavy Atoms | 32 |
| Complexity | 1477.9506 |
Chemical Identifiers
| CAS Number | 575470-55-2 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C/2\C(=O)N3C(=NN=C3S2)C4=CC=CC=C4)OCC5=CC=CC=C5 |
Product Overview
(E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one (CAS 575470-55-2), with molecular formula C25H19N3O3S and molecular weight 441.11 g/mol. IUPAC: (6E)-6-[(3-methoxy-4-phenylmethoxyphenyl)methylidene]-3-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one.
Chemical Property Profile of (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one
Property Insights of (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one
The XLogP value of 3.9533 indicates that (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-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 (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one. Following Lipinski's Rule of Five, (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one 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 (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one?
The CAS number of (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one is 575470-55-2.
What is the molecular formula of (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one?
The molecular formula of (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one is C25H19N3O3S.
What is the molecular weight of (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one?
The molecular weight of (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one is 441.11 g/mol.
Where can I buy (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one?
You can request a quote for (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-6-(4-(benzyloxy)-3-methoxybenzylidene)-3-phenylthiazolo[2,3-c][1,2,4]triazol-5(6H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.