N-[3-[4-(6-Fluoro-1,2-benzisoxazol-3yl)-1-piperidinyl]propyl]-6-acetyl-2-benzoxazolinone

HCID 10071753

Basic information

Standard SMILES
CC(=O)c1ccc2c(c1)oc(=O)n2CCCN1CCC(c2noc3cc(F)ccc23)CC1
InChIKey
LITRYFOHVTYUMZ-UHFFFAOYSA-N
Molecular formula
C24H24FN3O4
Average molar mass
437.5 g/mol

Names & identifiers

Preferred name
N-[3-[4-(6-Fluoro-1,2-benzisoxazol-3yl)-1-piperidinyl]propyl]-6-acetyl-2-benzoxazolinone
IUPAC
6-acetyl-3-[3-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]propyl]-1,3-benzoxazol-2-one

Names & synonyms

SCHEMBL1545054LITRYFOHVTYUMZ-UHFFFAOYSA-NN-[3-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]propyl]-6-acetyl-2-benzoxazolinoneN-[3-[4-(6-Fluoro-1,2-benzisoxazol-3yl)-1-piperidinyl]propyl]-6-acetyl-2-benzoxazolinoneN-[3-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]propyl]-6-acetyl-2- benzoxazolinone

Database identifiers

PubChem CID
10071753

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
75.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
32

Related reactions

73 records

Compound notes

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