CHEBI:93681 - 1-[4-[4-[(3,4-dimethoxyphenyl)methylamino]phenyl]-1-piperazinyl]ethanone

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ChEBI Name 1-[4-[4-[(3,4-dimethoxyphenyl)methylamino]phenyl]-1-piperazinyl]ethanone
ChEBI ID CHEBI:93681
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H27N3O3
Net Charge 0
Average Mass 369.458
Monoisotopic Mass 369.20524
InChI InChI=1S/C21H27N3O3/c1-16(25)23-10-12-24(13-11-23)19-7-5-18(6-8-19)22-15-17-4-9-20(26-2)21(14-17)27-3/h4-9,14,22H,10-13,15H2,1-3H3
InChIKey MAUJBUWKKPHCKN-UHFFFAOYSA-N
SMILES CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NCC3=CC(=C(C=C3)OC)OC
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 1-[4-[4-[(3,4-dimethoxyphenyl)methylamino]phenyl]-1-piperazinyl]ethanone (CHEBI:93681) is a aromatic amine (CHEBI:33860)
Manual Xref Database
LSM-4159 LINCS
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