Flonoltinib maleate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H34FN7O.C4H4O4
Molecular Weight	583.6543
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)\C=C\C(O)=O.CC(C)N1C=C(C=N1)C2=NC(NC3=CC(F)=C(C=C3)N4CCC(CC4)N(C)CCO)=NC=C2C

InChI

InChIKey=NLVFJAJYGCZTRV-WLHGVMLRSA-N

InChI=1S/C25H34FN7O.C4H4O4/c1-17(2)33-16-19(15-28-33)24-18(3)14-27-25(30-24)29-20-5-6-23(22(26)13-20)32-9-7-21(8-10-32)31(4)11-12-34;5-3(6)1-2-4(7)8/h5-6,13-17,21,34H,7-12H2,1-4H3,(H,27,29,30);1-2H,(H,5,6)(H,7,8)/b;2-1+

HIDE SMILES / InChI

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

Molecular Formula	C25H34FN7O
Molecular Weight	467.5822
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 `Sat Dec 16 19:47:53 GMT 2023` Edited by `admin` on `Sat Dec 16 19:47:53 GMT 2023`
Record UNII	U4VC53J387
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Flonoltinib maleate

Common Name

English

Ethanol, 2-[[1-[2-fluoro-4-[[5-methyl-4-[1-(1-methylethyl)-1H-pyrazol-4-yl]-2-pyrimidinyl]amino]phenyl]-4-piperidinyl]methylamino]-, maleate

Systematic Name

English

Code System Code Type Description

PUBCHEM

167713283

Created by admin on Sat Dec 16 19:47:53 GMT 2023 , Edited by admin on Sat Dec 16 19:47:53 GMT 2023

PRIMARY

CAS

2568842-58-8

Created by admin on Sat Dec 16 19:47:53 GMT 2023 , Edited by admin on Sat Dec 16 19:47:53 GMT 2023

NON-SPECIFIC STOICHIOMETRY

FDA UNII

U4VC53J387

Created by admin on Sat Dec 16 19:47:53 GMT 2023 , Edited by admin on Sat Dec 16 19:47:53 GMT 2023

PRIMARY