BGT-226 FREE BASE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C28H25F3N6O2
Molecular Weight	534.5323
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC=C(C=N1)C2=CC=C3N=CC4=C(N(C(=O)N4C)C5=CC=C(N6CCNCC6)C(=C5)C(F)(F)F)C3=C2

InChI

InChIKey=BMMXYEBLEBULND-UHFFFAOYSA-N

InChI=1S/C28H25F3N6O2/c1-35-24-16-33-22-6-3-17(18-4-8-25(39-2)34-15-18)13-20(22)26(24)37(27(35)38)19-5-7-23(21(14-19)28(29,30)31)36-11-9-32-10-12-36/h3-8,13-16,32H,9-12H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C28H25F3N6O2
Molecular Weight	534.5323
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 05:41:45 UTC 2023` Edited by `admin` on `Sat Dec 16 05:41:45 UTC 2023`
Record UNII	ZXE7F2GMJJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BGT-226 FREE BASE

Common Name

English

2H-IMIDAZO(4,5-C)QUINOLIN-2-ONE, 1,3-DIHYDRO-8-(6-METHOXY-3-PYRIDINYL)-3-METHYL-1-(4-(1-PIPERAZINYL)-3-(TRIFLUOROMETHYL)PHENYL)-

Systematic Name

English

8-(6-METHOXYPYRIDIN-3-YL)-3-METHYL-1-(4-(PIPERAZIN-1-YL)-3-(TRIFLUOROMETHYL)PHENYL)-1H-IMIDAZO(4,5-C)QUINOLIN-2(3H)-ONE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID60238600

Created by admin on Sat Dec 16 05:41:45 UTC 2023 , Edited by admin on Sat Dec 16 05:41:45 UTC 2023

PRIMARY

PUBCHEM

11978790

Created by admin on Sat Dec 16 05:41:45 UTC 2023 , Edited by admin on Sat Dec 16 05:41:45 UTC 2023

PRIMARY

CAS

915020-55-2

Created by admin on Sat Dec 16 05:41:45 UTC 2023 , Edited by admin on Sat Dec 16 05:41:45 UTC 2023

PRIMARY

FDA UNII

ZXE7F2GMJJ

Created by admin on Sat Dec 16 05:41:45 UTC 2023 , Edited by admin on Sat Dec 16 05:41:45 UTC 2023

PRIMARY

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