NGD-8243

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H12F6N4
Molecular Weight	434.3372
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

FC(F)(F)C1=CC=C(NC2=C3C=CC(=CC3=NC=N2)C4=C(C=CC=N4)C(F)(F)F)C=C1

InChI

InChIKey=VTANGSDRFFLTSQ-UHFFFAOYSA-N

InChI=1S/C21H12F6N4/c22-20(23,24)13-4-6-14(7-5-13)31-19-15-8-3-12(10-17(15)29-11-30-19)18-16(21(25,26)27)2-1-9-28-18/h1-11H,(H,29,30,31)

HIDE SMILES / InChI

Molecular Formula	C21H12F6N4
Molecular Weight	434.3372
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:34:47 GMT 2023` Edited by `admin` on `Sat Dec 16 08:34:47 GMT 2023`
Record UNII	K3S4K8ACHE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NGD-8243

Common Name

English

4-((4-(TRIFLUOROMETHYL)PHENYL)AMINO)-7-(3-(TRIFLUOROMETHYL)PYRIDIN-2-YL)QUINAZOLINE

Systematic Name

English

4-QUINAZOLINAMINE, N-(4-(TRIFLUOROMETHYL)PHENYL)-7-(3-(TRIFLUOROMETHYL)-2-PYRIDINYL)-

Systematic Name

English

(4-(TRIFLUOROMETHYL)PHENYL)-(7-(3-(TRIFLUOROMETHYL)PYRIDIN-2-YL)QUINAZOLIN-4-YL)AMINE

Systematic Name

English

MK-2295-005

Code

English

Code System Code Type Description

CAS

573678-04-3

Created by admin on Sat Dec 16 08:34:47 GMT 2023 , Edited by admin on Sat Dec 16 08:34:47 GMT 2023

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PUBCHEM

11247522

Created by admin on Sat Dec 16 08:34:47 GMT 2023 , Edited by admin on Sat Dec 16 08:34:47 GMT 2023

PRIMARY

ChEMBL

CHEMBL3545227

Created by admin on Sat Dec 16 08:34:47 GMT 2023 , Edited by admin on Sat Dec 16 08:34:47 GMT 2023

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FDA UNII

K3S4K8ACHE

Created by admin on Sat Dec 16 08:34:47 GMT 2023 , Edited by admin on Sat Dec 16 08:34:47 GMT 2023

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Related Record Type Details


					K3S4K8ACHE

NGD-8243

ACTIVE MOIETY