BW-114

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H15NO4S
Molecular Weight	365.402
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC1(C=CC(=O)C=C1)C2=CC3=C(C=CC=C3)N2S(=O)(=O)C4=CC=CC=C4

InChI

InChIKey=HWKQYGBAAMKHDY-UHFFFAOYSA-N

InChI=1S/C20H15NO4S/c22-16-10-12-20(23,13-11-16)19-14-15-6-4-5-9-18(15)21(19)26(24,25)17-7-2-1-3-8-17/h1-14,23H

HIDE SMILES / InChI

Molecular Formula	C20H15NO4S
Molecular Weight	365.402
Charge	0
Count

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

Approval Year

PubMed

Title	Date	PubMed
Antitumor quinols: role of glutathione in modulating quinol-induced apoptosis and identification of putative cellular protein targets.	2006-07-21	16756956
Elucidation of thioredoxin as a molecular target for antitumor quinols.	2005-05-01	15867391

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:08:08 GMT 2025` Edited by `admin` on `Mon Mar 31 22:08:08 GMT 2025`
Record UNII	Z12NZ7V81Z
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

1H-INDOLE, 2-(1-HYDROXY-4-OXO-2,5-CYCLOHEXADIEN-1-YL)-1-(PHENYLSULFONYL)-

Preferred Name

English

BW-114

Common Name

English

2,5-CYCLOHEXADIEN-1-ONE, 4-HYDROXY-4-(1-(PHENYLSULFONYL)-1H-INDOL-2-YL)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

9907134

Created by admin on Mon Mar 31 22:08:08 GMT 2025 , Edited by admin on Mon Mar 31 22:08:08 GMT 2025

PRIMARY

FDA UNII

Z12NZ7V81Z

Created by admin on Mon Mar 31 22:08:08 GMT 2025 , Edited by admin on Mon Mar 31 22:08:08 GMT 2025

PRIMARY

EPA CompTox

DTXSID401153476

Created by admin on Mon Mar 31 22:08:08 GMT 2025 , Edited by admin on Mon Mar 31 22:08:08 GMT 2025

PRIMARY

CAS

719308-90-4

Created by admin on Mon Mar 31 22:08:08 GMT 2025 , Edited by admin on Mon Mar 31 22:08:08 GMT 2025

PRIMARY

Related Record Type Details


					Z12NZ7V81Z

BW-114

ACTIVE MOIETY