![(E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one structure](/static/products/768/768287-27-0.png)
(E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
TL;DR: (E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one (CAS 768287-27-0) is a chemical compound with molecular formula C19H14N4O5S and molecular weight 410.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6E)-3-(3,4-dimethoxyphenyl)-6-[(3-nitrophenyl)methylidene]-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one
Also Known As: (E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one, (6E)-3-(3,4-dimethoxyphenyl)-6-[(3-nitrophenyl)methylidene]-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one
| Molecular Formula | C19H14N4O5S |
|---|---|
| Molecular Weight | 410.07 g/mol |
| LogP | 2.2911 |
| Topological Polar Surface Area | 108.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 410.06848 |
| Heavy Atoms | 29 |
| Complexity | 1344.6356 |
Chemical Identifiers
| CAS Number | 768287-27-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NN=C3N2C(=O)/C(=C\C4=CC(=CC=C4)[N+](=O)[O-])/S3)OC |
Product Overview
(E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one (CAS 768287-27-0), with molecular formula C19H14N4O5S and molecular weight 410.07 g/mol. IUPAC: (6E)-3-(3,4-dimethoxyphenyl)-6-[(3-nitrophenyl)methylidene]-[1,3]thiazolo[2,3-c][1,2,4]triazol-5-one.
Chemical Property Profile of (E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
Property Insights of (E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one
The XLogP value of 2.2911 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one. The TPSA of 108.86 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one. Following Lipinski's Rule of Five, (E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one has 0 hydrogen bond donor(s) and 8 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)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one?
The CAS number of (E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one is 768287-27-0.
What is the molecular formula of (E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one?
The molecular formula of (E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one is C19H14N4O5S.
What is the molecular weight of (E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one?
The molecular weight of (E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one is 410.07 g/mol.
Where can I buy (E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one?
You can request a quote for (E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[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)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(3,4-dimethoxyphenyl)-6-(3-nitrobenzylidene)thiazolo[2,3-c][1,2,4]triazol-5(6H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.