(6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one
TL;DR: (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one (CAS 573935-64-5) is a chemical compound with molecular formula C19H14ClN3O3S and molecular weight 399.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one
Also Known As: (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one, (6Z)-6-(2-chlorobenzylidene)-3-(3,4-dimethoxyphenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one, (E)-6-(2-chlorobenzylidene)-3-(3,4-dimethoxyphenyl)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
| Molecular Formula | C19H14ClN3O3S |
|---|---|
| Molecular Weight | 399.04 g/mol |
| LogP | 3.0363 |
| Topological Polar Surface Area | 65.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 399.04443 |
| Heavy Atoms | 27 |
| Complexity | 1249.0492 |
Chemical Identifiers
| CAS Number | 573935-64-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NN=C3N2C(=O)/C(=C\C4=CC=CC=C4Cl)/S3)OC |
Product Overview
(6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one (CAS 573935-64-5), with molecular formula C19H14ClN3O3S and molecular weight 399.04 g/mol. IUPAC: (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one.
Chemical Property Profile of (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one
Property Insights of (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one
The XLogP value of 3.0363 indicates that (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-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 (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one. Following Lipinski's Rule of Five, (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-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 (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one?
The CAS number of (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one is 573935-64-5.
What is the molecular formula of (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one?
The molecular formula of (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one is C19H14ClN3O3S.
What is the molecular weight of (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one?
The molecular weight of (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one is 399.04 g/mol.
Where can I buy (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one?
You can request a quote for (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one?
Yes, KEHONG BIO provides custom synthesis services for (6E)-6-[(2-chlorophenyl)methylidene]-3-(3,4-dimethoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.