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6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine structure
Fine Chemical

6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

TL;DR: 6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine (CAS 162207-96-7) is a chemical compound with molecular formula C14H16N4S and molecular weight 272.10956 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

Also Known As: 6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine, BRD-K21306839-001-01-6, 6-(tert-butyl)-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine, 6-(tert-butyl)-3-phenyl-7H-1,2,4-triazolo[3,4-b]1,3,4-thiadiazine

CAS Number
162207-96-7
Molecular Formula
C14H16N4S
Molecular Weight
272.10956 g/mol
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Technical Specifications

Molecular FormulaC14H16N4S
Molecular Weight272.10956 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)68.4 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds2
Exact Mass272.10956 Da
Heavy Atoms19
Complexity357.0
SMILESCC(C)(C)C1=NN2C(=NN=C2SC1)C3=CC=CC=C3
InChIKeyHFQCWXSBSSZQNC-UHFFFAOYSA-N

Chemical Property Profile of 6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

XLogP
3.3
TPSA (Topological Polar Surface Area)
68.4
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
2
Heavy Atoms
19
Complexity
357.0
Exact Mass
272.10956
Monoisotopic Mass
272.10956
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 6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

The XLogP value of 3.3 indicates that 6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine. Following Lipinski's Rule of Five, 6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?

The CAS number of 6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine is 162207-96-7.

What is the molecular formula of 6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?

The molecular formula of 6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine is C14H16N4S.

What is the molecular weight of 6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?

The molecular weight of 6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine is 272.10956 g/mol.

Where can I buy 6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?

You can request a quote for 6-tert-butyl-3-phenyl-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 6-tert-butyl-3-phenyl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine?

Yes, CoreyChem provides custom synthesis services for 6-tert-butyl-3-phenyl-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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