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3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine structure
Fine Chemical

3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

TL;DR: 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine (CAS 125866-81-1) is a chemical compound with molecular formula C13H14N4O2S and molecular weight 290.08374 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

Also Known As: 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

CAS Number
125866-81-1
Molecular Formula
C13H14N4O2S
Molecular Weight
290.08374 g/mol
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Technical Specifications

Molecular FormulaC13H14N4O2S
Molecular Weight290.08374 g/mol
XLogP1.9
Topological Polar Surface Area (TPSA)86.8 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors6
Rotatable Bonds3
Exact Mass290.08374 Da
Heavy Atoms20
Complexity381.0
SMILESCC1=NN2C(=NN=C2SC1)C3=CC(=C(C=C3)OC)OC
InChIKeyMFSYNJQNZQWEPK-UHFFFAOYSA-N

Chemical Property Profile of 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

XLogP
1.9
TPSA (Topological Polar Surface Area)
86.8
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
6
Rotatable Bonds
3
Heavy Atoms
20
Complexity
381.0
Exact Mass
290.08374
Monoisotopic Mass
290.08374
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine. The TPSA of 86.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine. Following Lipinski's Rule of Five, 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine 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

What is the CAS number of 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?

The CAS number of 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine is 125866-81-1.

What is the molecular formula of 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?

The molecular formula of 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine is C13H14N4O2S.

What is the molecular weight of 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?

The molecular weight of 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine is 290.08374 g/mol.

Where can I buy 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?

You can request a quote for 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?

Yes, CoreyChem provides custom synthesis services for 3-(3,4-dimethoxyphenyl)-6-methyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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