A-6730

Details

Stereochemistry	ACHIRAL
Molecular Formula	C34H29N7O
Molecular Weight	551.6404
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O=C1NC2=CC=CC=C2N1C3CCN(CC4=CC=C(C=C4)C5=C(N=C6C=C7N=CNC7=CC6=N5)C8=CC=CC=C8)CC3

InChI

InChIKey=BIWGYFZAEWGBAL-UHFFFAOYSA-N

InChI=1S/C34H29N7O/c42-34-39-26-8-4-5-9-31(26)41(34)25-14-16-40(17-15-25)20-22-10-12-24(13-11-22)33-32(23-6-2-1-3-7-23)37-29-18-27-28(36-21-35-27)19-30(29)38-33/h1-13,18-19,21,25H,14-17,20H2,(H,35,36)(H,39,42)

HIDE SMILES / InChI

Molecular Formula	C34H29N7O
Molecular Weight	551.6404
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	Potency
Serine/threonine-protein kinase AKT 29 Target ID: CHEMBL4282 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18054229	Inhibitor 8297	58.0 nM [IC50]
Serine/threonine-protein kinase AKT2 17 Target ID: CHEMBL2431 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18054229	Inhibitor 8297	210.0 nM [IC50]
Serine/threonine-protein kinase AKT3 17 Target ID: CHEMBL4816 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18054229	Inhibitor 8297	2200.0 nM [IC50]

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:47:02 GMT 2023` Edited by `admin` on `Sat Dec 16 18:47:02 GMT 2023`
Record UNII	YX4CPQ6V6X
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

A-6730

Code

English

AKT-I 1,2

Code

English

AKT-INHIBITOR-1-2

Common Name

English

AKT INHIBITOR VIII

Common Name

English

2H-BENZIMIDAZOL-2-ONE, 1,3-DIHYDRO-1-(1-((4-(6-PHENYL-1H-IMIDAZO(4,5-G)QUINOXALIN-7-YL)PHENYL)METHYL)-4-PIPERIDINYL)-

Common Name

English

1,3-DIHYDRO-1-(1-((4-(6-PHENYL-1H-IMIDAZO(4,5-G)QUINOXALIN-7-YL)PHENYL)METHYL)-4-PIPERIDINYL)-2H-BENZIMIDAZOL-2-ONE

Common Name

English

Code System Code Type Description

CAS

612847-09-3

Created by admin on Sat Dec 16 18:47:02 GMT 2023 , Edited by admin on Sat Dec 16 18:47:02 GMT 2023

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FDA UNII

YX4CPQ6V6X

Created by admin on Sat Dec 16 18:47:02 GMT 2023 , Edited by admin on Sat Dec 16 18:47:02 GMT 2023

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EPA CompTox

DTXSID50436572

Created by admin on Sat Dec 16 18:47:02 GMT 2023 , Edited by admin on Sat Dec 16 18:47:02 GMT 2023

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