1-(4-Ethylpiperazin-1-yl)-3-(4-methoxyphenyl)isoquinoline

HCID 9950168
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Basic information

Standard SMILES
CCN1CCN(c2nc(-c3ccc(OC)cc3)cc3ccccc23)CC1
InChIKey
JZOXALOWGSZCKQ-UHFFFAOYSA-N
Molecular formula
C22H25N3O
Average molar mass
347.5 g/mol
Monoisotopic mass
347.19976243

Names & identifiers

Preferred name
1-(4-Ethylpiperazin-1-yl)-3-(4-methoxyphenyl)isoquinoline
IUPAC
1-(4-ethylpiperazin-1-yl)-3-(4-methoxyphenyl)isoquinoline

Names & synonyms

SCHEMBL47635661-(4-ethylpiperazin-1-yl)-3-(4-methoxyphenyl)isoquinolineJZOXALOWGSZCKQ-UHFFFAOYSA-N1-(4-ethylpiperazin-1-yl)-3(4-methoxyphenyl)isoquinoline

Database identifiers

PubChem CID
9950168

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
28.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
26

Related reactions

7 records
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Compound notes

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