![1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone structure](/static/products/3073/307343-87-9.webp)
1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone
TL;DR: 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone (CAS 307343-87-9) is a chemical compound with molecular formula C18H15N3O3S2 and molecular weight 385.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dimethoxyphenyl)-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)ethanone
Also Known As: AF-399/13276017, 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone, 1-(3,4-dimethoxyphenyl)-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylthio)ethanone, 1-(3,4-dimethoxyphenyl)-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)ethanone, 1-(3,4-dimethoxyphenyl)-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)ethanone
| Molecular Formula | C18H15N3O3S2 |
|---|---|
| Molecular Weight | 385.06 g/mol |
| LogP | 3.9362 |
| Topological Polar Surface Area | 65.72 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 385.05548 |
| Heavy Atoms | 26 |
| Complexity | 1103.6556 |
Chemical Identifiers
| CAS Number | 307343-87-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)CSC2=NN=C3N2C4=CC=CC=C4S3)OC |
Product Overview
1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone (CAS 307343-87-9), with molecular formula C18H15N3O3S2 and molecular weight 385.06 g/mol. IUPAC: 1-(3,4-dimethoxyphenyl)-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)ethanone.
Chemical Property Profile of 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone
Property Insights of 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone
The XLogP value of 3.9362 indicates that 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone 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 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone. Following Lipinski's Rule of Five, 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone has 0 hydrogen bond donor(s) and 7 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 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone?
The CAS number of 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone is 307343-87-9.
What is the molecular formula of 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone?
The molecular formula of 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone is C18H15N3O3S2.
What is the molecular weight of 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone?
The molecular weight of 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone is 385.06 g/mol.
Where can I buy 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone?
You can request a quote for 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dimethoxyphenyl)-2-(1,2,4-triazolo[3,4-b]benzothiazol-3-ylthio)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.