1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-N-methyl-3,4-dihydro-1H-isochromene-6-carboxamide (CHEBI:140906)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-N-methyl-3,4-dihydro-1H-isochromene-6-carboxamide

ChEBI ID	CHEBI:140906

Stars	This entity has been manually annotated by a third party.

Submitter	Ceri

Supplier Information

Download	Molfile XML SDF

Formula

C24H31N3O3

Net Charge

Average Mass

409.530

Monoisotopic Mass

409.23654

InChI

InChI=1S/C24H31N3O3/c1-25-24(28)19-3-8-22-18(17-19)10-16-30-23(22)9-11-26-12-14-27(15-13-26)20-4-6-21(29-2)7-5-20/h3-8,17,23H,9-16H2,1-2H3,(H,25,28)

InChIKey

UDLSEQDYARNKTL-UHFFFAOYSA-N

SMILES

O1C(CCN2CCN(CC2)C3=CC=C(OC)C=C3)C4=C(CC1)C=C(C=C4)C(=O)NC

Roles Classification
Application(s):	receptor modulator A drug that acts as an antagonist, agonist, reverse agonist, or in some other fashion when interacting with cellular receptors.

ChEBI Ontology
Outgoing	1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-N-methyl-3,4-dihydro-1H-isochromene-6-carboxamide (CHEBI:140906) has role receptor modulator (CHEBI:90710) 1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-N-methyl-3,4-dihydro-1H-isochromene-6-carboxamide (CHEBI:140906) is a organic molecular entity (CHEBI:50860) 1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-N-methyl-3,4-dihydro-1H-isochromene-6-carboxamide (CHEBI:140906) is a organonitrogen heterocyclic compound (CHEBI:38101)

Registry Number	Type	Source
187665-60-7	CAS Registry Number	SUBMITTER