1,3,4-Thiadiazol-2-amine, 5-phenyl-


Chemical Name: 1,3,4-Thiadiazol-2-amine, 5-phenyl-
CAS Number: 2002-03-1
Product Number: AG002CM9(AGN-PC-0JN9JU)
Synonyms:
MDL No:
Molecular Formula: C8H7N3S
Molecular Weight: 177.2263

Identification/Properties


Computed Properties
Molecular Weight:
177.225g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
177.036g/mol
Monoisotopic Mass:
177.036g/mol
Topological Polar Surface Area:
80A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
147
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



1,3,4-Thiadiazol-2-amine, 5-phenyl- is a versatile compound commonly used in chemical synthesis for its unique properties and reactivity. This compound serves as a key building block in the creation of various organic molecules and pharmaceuticals due to its ability to participate in a variety of chemical reactions.In organic synthesis, 1,3,4-Thiadiazol-2-amine, 5-phenyl- can be employed as a precursor for the preparation of heterocyclic compounds, which are widely utilized in the pharmaceutical industry. Its incorporation into molecular structures can impart desirable biological activities and enhance the potency of drug candidates. Additionally, this compound can serve as a valuable starting material for the synthesis of agrochemicals, dyes, and materials for diverse applications.Furthermore, 1,3,4-Thiadiazol-2-amine, 5-phenyl- plays a crucial role in medicinal chemistry, where it is utilized in the design and development of new therapeutic agents. By introducing this moiety into drug molecules, researchers can modulate their physicochemical properties and pharmacological profiles, potentially leading to the discovery of novel medications with improved efficacy and reduced side effects.Overall, the versatile nature of 1,3,4-Thiadiazol-2-amine, 5-phenyl- makes it a valuable tool in the hands of synthetic chemists and pharmaceutical scientists striving to create innovative compounds with diverse applications.