1-{3-[3-(4-fluorophenyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]phenoxyacetyl}-4-methylpiperazine

HCID 14796331
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Basic information

Standard SMILES
CN1CCN(C(=O)COc2cccc(-n3nc(-c4ccc(F)cc4)c4cccnc43)c2)CC1
InChIKey
OUVRZZSCEBLQBB-UHFFFAOYSA-N
Molecular formula
C25H24FN5O2
Average molar mass
445.5 g/mol

Names & identifiers

Preferred name
1-{3-[3-(4-fluorophenyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]phenoxyacetyl}-4-methylpiperazine
IUPAC
2-[3-[3-(4-fluorophenyl)pyrazolo[5,4-b]pyridin-1-yl]phenoxy]-1-(4-methylpiperazin-1-yl)ethanone

Names & synonyms

SCHEMBL9235636OUVRZZSCEBLQBB-UHFFFAOYSA-N1-{3-[3-(4-fluorophenyl)-1H-pyrazolo[3,4-b]pyridin-1-yl]phenoxyacetyl}-4-methylpiperazine

Database identifiers

PubChem CID
14796331

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
63.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
33

Related reactions

2 records
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Compound notes

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