4,4'-(((Piperazine-1,4-dicarbonyl)bis(4-fluoro-3,1-phenylene))bis(methylene))bis(phthalazin-1(2H)-one)

Details

Stereochemistry	ACHIRAL
Molecular Formula	C36H28F2N6O4
Molecular Weight	646.6421
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4,4'-(((Piperazine-1,4-dicarbonyl)bis(4-fluoro-3,1-phenylene))bis(methylene))bis(phthalazin-1(2H)-one)

Structure Search

SMILES

FC1=CC=C(CC2=NNC(=O)C3=C2C=CC=C3)C=C1C(=O)N4CCN(CC4)C(=O)C5=C(F)C=CC(CC6=NNC(=O)C7=C6C=CC=C7)=C5

InChI

InChIKey=FYNNYPQKUUOJBO-UHFFFAOYSA-N

InChI=1S/C36H28F2N6O4/c37-29-11-9-21(19-31-23-5-1-3-7-25(23)33(45)41-39-31)17-27(29)35(47)43-13-15-44(16-14-43)36(48)28-18-22(10-12-30(28)38)20-32-24-6-2-4-8-26(24)34(46)42-40-32/h1-12,17-18H,13-16,19-20H2,(H,41,45)(H,42,46)

HIDE SMILES / InChI

Molecular Formula	C36H28F2N6O4
Molecular Weight	646.6421
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 16:57:49 GMT 2025` Edited by `admin` on `Wed Apr 02 16:57:49 GMT 2025`
Record UNII	MUG86ZF4B3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4,4'-(((Piperazine-1,4-dicarbonyl)bis(4-fluoro-3,1-phenylene))bis(methylene))bis(phthalazin-1(2H)-one)

Systematic Name

English

Olaparib impurity 14

Preferred Name

English

4-{[4-fluoro-3-(4-{2-fluoro-5-[(4-oxo-3,4-dihydrophthalazin-1-yl)methyl]benzoyl}piperazine-1-carbonyl)phenyl]methyl}-1,2-dihydrophthalazin-1-one

Systematic Name

English

1(2H)-Phthalazinone, 4,4?-[1,4-piperazinediylbis[carbonyl(4-fluoro-3,1-phenylene)methylene]]bis-

Systematic Name

English

4,4?-[1,4-Piperazinediylbis[carbonyl(4-fluoro-3,1-phenylene)methylene]]bis[1(2H)-phthalazinone]

Systematic Name

English

Code System Code Type Description

PUBCHEM

132103527

Created by admin on Wed Apr 02 16:57:49 GMT 2025 , Edited by admin on Wed Apr 02 16:57:49 GMT 2025

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CAS

2250242-62-5

Created by admin on Wed Apr 02 16:57:49 GMT 2025 , Edited by admin on Wed Apr 02 16:57:49 GMT 2025

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FDA UNII

MUG86ZF4B3

Created by admin on Wed Apr 02 16:57:49 GMT 2025 , Edited by admin on Wed Apr 02 16:57:49 GMT 2025

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