6-[2-[4-[(4-fluorophenyl)-phenylmethylidene]piperidin-1-yl]ethyl]-7-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one


Chemical Name: 6-[2-[4-[(4-fluorophenyl)-phenylmethylidene]piperidin-1-yl]ethyl]-7-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CAS Number: 93076-89-2
Product Number: AG00GRTS(AGN-PC-0JK6EU)
Synonyms:
MDL No: MFCD00055114
Molecular Formula: C27H26FN3OS
Molecular Weight: 459.5782

Identification/Properties


Computed Properties
Molecular Weight:
459.583g/mol
XLogP3:
5.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
5
Exact Mass:
459.178g/mol
Monoisotopic Mass:
459.178g/mol
Topological Polar Surface Area:
61.2A^2
Heavy Atom Count:
33
Formal Charge:
0
Complexity:
868
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

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Chemical Structure



The compound $name$ is utilized in chemical synthesis as a versatile building block due to its unique structure and functional groups. It serves as a key intermediate in the creation of various organic compounds, especially in the pharmaceutical and material science industries. With its 5H-thiazolo[3,2-a]pyrimidin-5-one core and substituted piperidine moiety, $name$ offers opportunities for diversification through selective functional group transformations. These transformations enable the introduction of additional complexity and functionalities, making it a valuable tool for the synthesis of novel organic molecules. Additionally, the presence of the fluoro-substituted phenyl groups enhances the chemical reactivity and potential for further derivatization, expanding the scope of applications in synthetic chemistry.