Tert-butyl 4-(2-fluorobenzoyl)-3-((pyridin-3-yloxy)methyl)piperazine-1-carboxylate

HCID 66796871
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Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCN(C(=O)c2ccccc2F)C(COc2cccnc2)C1
InChIKey
OMNICCRDKULBJL-UHFFFAOYSA-N
Molecular formula
C22H26FN3O4
Average molar mass
415.5 g/mol

Names & identifiers

Preferred name
Tert-butyl 4-(2-fluorobenzoyl)-3-((pyridin-3-yloxy)methyl)piperazine-1-carboxylate
IUPAC
tert-butyl 4-(2-fluorobenzoyl)-3-(pyridin-3-yloxymethyl)piperazine-1-carboxylate

Names & synonyms

SCHEMBL779354OMNICCRDKULBJL-UHFFFAOYSA-Ntert-butyl 4-(2-fluorobenzoyl)-3-((pyridin-3-yloxy)methyl)piperazine-1-carboxylate

Database identifiers

PubChem CID
66796871

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
72 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
30

Related reactions

3 records
New reaction record

Linked notes

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