N-(2,6-dimethylphenyl)-2-{4-[4-(4-methoxyphenyl)-2-hydroxybutyl]piperazinyl}acetamide

HCID 12052937
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Basic information

Standard SMILES
COc1ccc(CCC(O)CN2CCN(CC(=O)Nc3c(C)cccc3C)CC2)cc1
InChIKey
NWENZKGHGGBLQY-UHFFFAOYSA-N
Molecular formula
C25H35N3O3
Average molar mass
425.6 g/mol

Names & identifiers

Preferred name
N-(2,6-dimethylphenyl)-2-{4-[4-(4-methoxyphenyl)-2-hydroxybutyl]piperazinyl}acetamide
IUPAC
N-(2,6-dimethylphenyl)-2-[4-[2-hydroxy-4-(4-methoxyphenyl)butyl]piperazin-1-yl]acetamide

Names & synonyms

SCHEMBL6285294NWENZKGHGGBLQY-UHFFFAOYSA-NN-(2,6-dimethylphenyl)-2-{4-[4-(4-methoxyphenyl)-2-hydroxybutyl]piperazinyl}acetamide

Database identifiers

PubChem CID
12052937

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
65 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
31

Related reactions

8 records
New reaction record

Linked notes

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