Desmethyldovitinib

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H19FN6O
Molecular Weight	378.4029
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC1=C(C2=NC3=C(N2)C=C(C=C3)N4CCNCC4)C(=O)NC5=C1C(F)=CC=C5

InChI

InChIKey=DRUNJGIEUWMQHG-UHFFFAOYSA-N

InChI=1S/C20H19FN6O/c21-12-2-1-3-14-16(12)18(22)17(20(28)26-14)19-24-13-5-4-11(10-15(13)25-19)27-8-6-23-7-9-27/h1-5,10,23H,6-9H2,(H,24,25)(H3,22,26,28)

HIDE SMILES / InChI

Molecular Formula	C20H19FN6O
Molecular Weight	378.4029
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 `Wed Apr 02 17:09:21 GMT 2025` Edited by `admin` on `Wed Apr 02 17:09:21 GMT 2025`
Record UNII	ZVJ3QQH95R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CZC-17647

Preferred Name

English

Desmethyldovitinib

Common Name

English

4-Amino-5-fluoro-3-[6-(1-piperazinyl)-1H-benzimidazol-2-yl]-2(1H)-quinolinone

Systematic Name

English

Dovitinib metabolite M8

Common Name

English

2(1H)-Quinolinone, 4-amino-5-fluoro-3-[5-(1-piperazinyl)-1H-benzimidazol-2-yl]-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID10747550

Created by admin on Wed Apr 02 17:09:21 GMT 2025 , Edited by admin on Wed Apr 02 17:09:21 GMT 2025

PRIMARY

PUBCHEM

135543684

Created by admin on Wed Apr 02 17:09:21 GMT 2025 , Edited by admin on Wed Apr 02 17:09:21 GMT 2025

PRIMARY

CAS

668432-44-8

Created by admin on Wed Apr 02 17:09:21 GMT 2025 , Edited by admin on Wed Apr 02 17:09:21 GMT 2025

PRIMARY

FDA UNII

ZVJ3QQH95R

Created by admin on Wed Apr 02 17:09:21 GMT 2025 , Edited by admin on Wed Apr 02 17:09:21 GMT 2025

PRIMARY

Related Record Type Details


					I35H55G906

DOVITINIB

PARENT -> METABOLITE

Interaction Type:

MAJOR

Qualification:

FECAL

Amount: