3-Amino-6-methyl-1-(3-(trifluoromethyl)phenyl)pyridazin-4(1H)-one

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H10F3N3O
Molecular Weight	269.2225
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-Amino-6-methyl-1-(3-(trifluoromethyl)phenyl)pyridazin-4(1H)-one

Structure Search

SMILES

CC1=CC(=O)C(N)=NN1C2=CC(=CC=C2)C(F)(F)F

InChI

InChIKey=MRMGTEKECRMLOG-UHFFFAOYSA-N

InChI=1S/C12H10F3N3O/c1-7-5-10(19)11(16)17-18(7)9-4-2-3-8(6-9)12(13,14)15/h2-6H,1H3,(H2,16,17)

HIDE SMILES / InChI

Molecular Formula	C12H10F3N3O
Molecular Weight	269.2225
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
GABA-A receptor; benzodiazepine site 38 Target ID: CHEMBL2109243 Sources: https://www.ncbi.nlm.nih.gov/pubmed/7913225	Modulator 828

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:36:16 GMT 2023` Edited by `admin` on `Fri Dec 15 18:36:16 GMT 2023`
Record UNII	3J5V7FAJ9A
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-Amino-6-methyl-1-(3-(trifluoromethyl)phenyl)pyridazin-4(1H)-one

Systematic Name

English

F-2692

Common Name

English

3-Amino-6-methyl-1-[3-(trifluoromethyl)phenyl]-1,4-dihydropyridazin-4-one

Systematic Name

English

4(1H)-Pyridazinone, 3-amino-6-methyl-1-[3-(trifluoromethyl)phenyl]-

Systematic Name

English

3-Amino-6-methyl-1-[3-(trifluoromethyl)phenyl]-4(1H)-pyridazinone

Systematic Name

English

Code System Code Type Description

PUBCHEM

10221045

Created by admin on Fri Dec 15 18:36:16 GMT 2023 , Edited by admin on Fri Dec 15 18:36:16 GMT 2023

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EPA CompTox

DTXSID50928008

Created by admin on Fri Dec 15 18:36:16 GMT 2023 , Edited by admin on Fri Dec 15 18:36:16 GMT 2023

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FDA UNII

3J5V7FAJ9A

Created by admin on Fri Dec 15 18:36:16 GMT 2023 , Edited by admin on Fri Dec 15 18:36:16 GMT 2023

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CAS

133220-91-4

Created by admin on Fri Dec 15 18:36:16 GMT 2023 , Edited by admin on Fri Dec 15 18:36:16 GMT 2023

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