1-[4-(3-Phenyl-4,5-dihydroisoxazol-5-yl)butyl]-4-(2-methylphenyl)piperazine

HCID 10293003
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Basic information

Standard SMILES
Cc1ccccc1N1CCN(CCCCC2CC(c3ccccc3)=NO2)CC1
InChIKey
YIRHDXREXIIZNY-UHFFFAOYSA-N
Molecular formula
C24H31N3O
Average molar mass
377.5 g/mol

Names & identifiers

Preferred name
1-[4-(3-Phenyl-4,5-dihydroisoxazol-5-yl)butyl]-4-(2-methylphenyl)piperazine
IUPAC
5-[4-[4-(2-methylphenyl)piperazin-1-yl]butyl]-3-phenyl-4,5-dihydro-1,2-oxazole

Names & synonyms

SCHEMBL6781263YIRHDXREXIIZNY-UHFFFAOYSA-N1-[4-(3-phenyl-4,5-dihydroisoxazol-5-yl)butyl]-4-(2-methylphenyl)piperazine

Database identifiers

PubChem CID
10293003

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
28.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
28

Related reactions

2 records
New reaction record

Linked notes

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