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Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H19F3N4O2
Molecular Weight	428.4071
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=CC2=C(C=C1C(F)(F)F)N(CC2)C(=O)NC3=CN=C(OC4=C(C)N=CC=C4)C=C3

InChI

InChIKey=ZETBBVYSBABLHL-UHFFFAOYSA-N

InChI=1S/C22H19F3N4O2/c1-13-10-15-7-9-29(18(15)11-17(13)22(23,24)25)21(30)28-16-5-6-20(27-12-16)31-19-4-3-8-26-14(19)2/h3-6,8,10-12H,7,9H2,1-2H3,(H,28,30)

HIDE SMILES / InChI

Molecular Formula	C22H19F3N4O2
Molecular Weight	428.4071
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Serotonin 2c (5-HT2c) receptor 124 Target ID: CHEMBL225 Sources: https://www.ncbi.nlm.nih.gov/pubmed/11489455	Inverse Agonist 80		9.37 null [pKi]

PubMed

Title	Date	PubMed
Selective activation of 5-HT(2C) receptors stimulates GABA-ergic function in the rat substantia nigra pars reticulata: a combined in vivo electrophysiological and neurochemical study.	2007 Feb 23	17161544

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:05:26 GMT 2023` Edited by `admin` on `Sat Dec 16 09:05:26 GMT 2023`
Record UNII	R6MR8DB4PZ
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

SB-243213 FREE BASE

Code

English

1H-INDOLE-1-CARBOXAMIDE, 2,3-DIHYDRO-5-METHYL-N-(6-((2-METHYL-3-PYRIDINYL)OXY)-3-PYRIDINYL)-6-(TRIFLUOROMETHYL)-

Systematic Name

English

5-METHYL-N-(6-((2-METHYLPYRIDIN-3-YL)OXY)PYRIDIN-3-YL)-6-(TRIFLUOROMETHYL)-2,3-DIHYDRO-1H-INDOLE-1-CARBOXAMIDE

Systematic Name

English

5-METHYL-1-((-2-((2-METHYL-3-PYRIDYL)OXY)-5-PYRIDYL)CARBAMOYL)-6-TRIFLUOROMETHYLINDOLINE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID0047323

Created by admin on Sat Dec 16 09:05:27 GMT 2023 , Edited by admin on Sat Dec 16 09:05:27 GMT 2023

PRIMARY

PUBCHEM

443391

Created by admin on Sat Dec 16 09:05:27 GMT 2023 , Edited by admin on Sat Dec 16 09:05:27 GMT 2023

PRIMARY

FDA UNII

R6MR8DB4PZ

Created by admin on Sat Dec 16 09:05:27 GMT 2023 , Edited by admin on Sat Dec 16 09:05:27 GMT 2023

PRIMARY

CAS

200940-22-3

Created by admin on Sat Dec 16 09:05:27 GMT 2023 , Edited by admin on Sat Dec 16 09:05:27 GMT 2023

PRIMARY

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