BLU-9931

Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H22Cl2N4O3
Molecular Weight	509.384
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC(OC)=C(Cl)C(C2=CC3=CN=C(NC4=C(C)C=CC=C4NC(=O)C=C)N=C3C=C2)=C1Cl

InChI

InChIKey=TXEBNKKOLVBTFK-UHFFFAOYSA-N

InChI=1S/C26H22Cl2N4O3/c1-5-21(33)30-18-8-6-7-14(2)25(18)32-26-29-13-16-11-15(9-10-17(16)31-26)22-23(27)19(34-3)12-20(35-4)24(22)28/h5-13H,1H2,2-4H3,(H,30,33)(H,29,31,32)

HIDE SMILES / InChI

Molecular Formula	C26H22Cl2N4O3
Molecular Weight	509.384
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	Condition	Potency
Fibroblast growth factor receptor 4 16 Target ID: P22455\|\|\|Q8TDA0 Gene ID: 2264.0 Gene Symbol: FGFR4 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/25776529	Inhibitor 8297		3.0 nM [IC50]

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:44:44 GMT 2023` Edited by `admin` on `Sat Dec 16 12:44:44 GMT 2023`
Record UNII	FQK825B5DX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BLU-9931

Code

English

BLU9931

Code

English

N-(2-((6-(2,6-DICHLORO-3,5-DIMETHOXYPHENYL)-2-QUINAZOLINYL)AMINO)-3-METHYLPHENYL)-2-PROPENAMIDE

Systematic Name

English

2-PROPENAMIDE, N-(2-((6-(2,6-DICHLORO-3,5-DIMETHOXYPHENYL)-2-QUINAZOLINYL)AMINO)-3-METHYLPHENYL)-

Systematic Name

English

BLU 9931 [WHO-DD]

Common Name

English

Classification Tree Code System Code

FDA ORPHAN DRUG

490915