ABIVERTINIB MALEATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H26FN7O2.C4H4O4.2H2O
Molecular Weight	639.6315
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O.O.OC(=O)\C=C/C(O)=O.CN1CCN(CC1)C2=C(F)C=C(NC3=NC(OC4=CC=CC(NC(=O)C=C)=C4)=C5C=CNC5=N3)C=C2

InChI

InChIKey=QITOONQVTOGMOJ-IUJXYRIYSA-N

InChI=1S/C26H26FN7O2.C4H4O4.2H2O/c1-3-23(35)29-17-5-4-6-19(15-17)36-25-20-9-10-28-24(20)31-26(32-25)30-18-7-8-22(21(27)16-18)34-13-11-33(2)12-14-34;5-3(6)1-2-4(7)8;;/h3-10,15-16H,1,11-14H2,2H3,(H,29,35)(H2,28,30,31,32);1-2H,(H,5,6)(H,7,8);2*1H2/b;2-1-;;

HIDE SMILES / InChI

Molecular Formula	C26H26FN7O2
Molecular Weight	487.5287
Charge	0
Count

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

Molecular Formula	H2O
Molecular Weight	18.0153
Charge	0
Count

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

Molecular Formula	C4H4O4
Molecular Weight	116.0722
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Epidermal growth factor receptor 46 Target ID: CHEMBL2363049 Sources: https://www.ncbi.nlm.nih.gov/pubmed/28414972	Inhibitor 8297

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:01:53 GMT 2023` Edited by `admin` on `Sat Dec 16 10:01:53 GMT 2023`
Record UNII	Y50131AMFJ
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ABIVERTINIB MALEATE

Official Name

English

ACEA100610MA

Code

English

A610MA

Code

English

EX-ACEA0010MA

Code

English

N-(3-(2-(3-FLUORO-4-(4-METHYL-PIPERAZIN-1-YL)-PHENYLAMINO)-7H-PYRROLO(2,3-D)PYRIMIDIN-4-YLOXY)-PHENYL)-ACRYLAMIDE MALEATE DI-HYDRATE

Systematic Name

English

ACEA-100610MA

Code

English

EX-ACEA-0010MA

Code

English

Abivertinib maleate [WHO-DD]

Common Name

English

ABIVERTINIB MALEATE [USAN]

Common Name

English

AC0010MA

Code

English

A-610MA

Code

English

AC0010 MALEATE DIHYDRATE

Common Name

English

AC-0010MA

Code

English

2-PROPENAMIDE, N-(3-((2-((3-FLUORO-4-(4-METHYL-1-PIPERAZINYL)PHENYL)AMINO)-7H-PYRROLO(2,3-D)PYRIMIDIN-4-YL)OXY)PHENYL)-, (2Z)-2-BUTENEDIOATE, HYDRATE (1:1:2)

Systematic Name

English

STI-5656

Code

English

ABIVERTINIB MALEATE DIHYDRATE

Common Name

English

Code System Code Type Description

PUBCHEM

137321960