N-2,1-benzisoxazol-3-yl-4-[3-(4-fluorophenoxy)benzylidene]piperidine-1-carboxamide

HCID 24968686
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Basic information

Standard SMILES
O=C(Nc1onc2ccccc12)N1CCC(=Cc2cccc(Oc3ccc(F)cc3)c2)CC1
InChIKey
PYQYQDTZHATYGX-UHFFFAOYSA-N
Molecular formula
C26H22FN3O3
Average molar mass
443.5 g/mol

Names & identifiers

Preferred name
N-2,1-benzisoxazol-3-yl-4-[3-(4-fluorophenoxy)benzylidene]piperidine-1-carboxamide
IUPAC
N-(2,1-benzoxazol-3-yl)-4-[[3-(4-fluorophenoxy)phenyl]methylidene]piperidine-1-carboxamide

Names & synonyms

SCHEMBL1010521PYQYQDTZHATYGX-UHFFFAOYSA-NN-2,1-benzisoxazol-3-yl-4-[3-(4-fluorophenoxy)benzylidene]piperidine-1-carboxamide

Database identifiers

PubChem CID
24968686

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
67.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
33

Related reactions

2 records
New reaction record

Compound notes

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