1-({2-[1-tert-butyl-5-(4-fluorophenyl)-1H-pyrazol-4-yl]-1,3-thiazol-4-yl}acetyl)azetidin-3-ol

HCID 86721189
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Basic information

Standard SMILES
CC(C)(C)n1ncc(-c2nc(CC(=O)N3CC(O)C3)cs2)c1-c1ccc(F)cc1
InChIKey
BAQHYHRDIGSHLK-UHFFFAOYSA-N
Molecular formula
C21H23FN4O2S
Average molar mass
414.5 g/mol

Names & identifiers

Preferred name
1-({2-[1-tert-butyl-5-(4-fluorophenyl)-1H-pyrazol-4-yl]-1,3-thiazol-4-yl}acetyl)azetidin-3-ol
IUPAC
2-[2-[1-tert-butyl-5-(4-fluorophenyl)pyrazol-4-yl]-1,3-thiazol-4-yl]-1-(3-hydroxyazetidin-1-yl)ethanone

Names & synonyms

SCHEMBL15750546BAQHYHRDIGSHLK-UHFFFAOYSA-N1-({2-[1-tert-butyl-5-(4-fluorophenyl)-1H-pyrazol-4-yl]-1,3-thiazol-4-yl}acetyl)azetidin-3-ol

Database identifiers

PubChem CID
86721189

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
99.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
29

Related reactions

1 records
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Compound notes

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