(4,4-Difluoro-piperidin-1-yl)-[6-(5-methyl-3-phenyl-isoxazol-4-ylmethoxy)-pyridin-3-yl]-methanone

HCID 68936616
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Basic information

Standard SMILES
Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)N2CCC(F)(F)CC2)cn1
InChIKey
BXGCHUBYXYXAEL-UHFFFAOYSA-N
Molecular formula
C22H21F2N3O3
Average molar mass
413.4 g/mol
Monoisotopic mass
413.15509786

Names & identifiers

Preferred name
(4,4-Difluoro-piperidin-1-yl)-[6-(5-methyl-3-phenyl-isoxazol-4-ylmethoxy)-pyridin-3-yl]-methanone
IUPAC
(4,4-difluoropiperidin-1-yl)-[6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]-3-pyridinyl]methanone

Names & synonyms

(4,4-Difluoro-piperidin-1-yl)-[6-(5-methyl-3-phenyl-isoxazol-4-ylmethoxy)-pyridin-3-yl]-methanoneSCHEMBL4159841CHEMBL3676504BDBM133369US8846719, 52

Database identifiers

PubChem CID
68936616
ChEMBL
CHEMBL3676504

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
68.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
30

Related reactions

5 records
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Compound notes

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