2-Methyl-2-propanyl 4-{2-fluoro-5-[(4-oxo-3,4-dihydro-1-phthalazi nyl)methyl]benzoyl}-1-piperazinecarboxylate

Modify Date: 2025-08-27 10:12:00

2-Methyl-2-propanyl 4-{2-fluoro-5-[(4-oxo-3,4-dihydro-1-phthalazi nyl)methyl]benzoyl}-1-piperazinecarboxylate structure	Common Name	2-Methyl-2-propanyl 4-{2-fluoro-5-[(4-oxo-3,4-dihydro-1-phthalazi nyl)methyl]benzoyl}-1-piperazinecarboxylate
	CAS Number	763114-04-1	Molecular Weight	466.50500
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₂₅H₂₇FN₄O₄	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	2-Methyl-2-propanyl 4-{2-fluoro-5-[(4-oxo-3,4-dihydro-1-phthalazi nyl)methyl]benzoyl}-1-piperazinecarboxylate
Synonym	More Synonyms

Molecular Formula	C₂₅H₂₇FN₄O₄
Molecular Weight	466.50500
Exact Mass	466.20200
PSA	95.86000
LogP	3.63400

2-fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)benzoicacid structure

2-fluoro-5-((4-...

CAS#:763114-26-7

N-Boc-piperazine structure

N-Boc-piperazine

CAS#:57260-71-6

~96%

2-Methyl-2-propanyl 4-{2-fluoro-5-[(4-oxo-3,4-dihydro-1-phthalazi nyl)methyl]benzoyl}-1-piperazinecarboxylate Structure

2-Methyl-2-prop...

CAS#:763114-04-1

Literature: Menear, Keith A.; Adcock, Claire; Boulter, Robert; Cockcroft, Xiao-Ling; Copsey, Louise; Cranston, Aaron; Dillon, Krystyna J.; Drzewiecki, Jan; Garman, Sheila; Gomez, Sylvie; Javaid, Hashim; Kerrigan, Frank; Knights, Charlotte; Lau, Alan; Loh Jr., Vincent M.; Matthews, Ian T. W.; Moore, Stephen; O'Connor, Mark J.; Smith, Graeme C. M.; Martin, Niall M. B. Journal of Medicinal Chemistry, 2008 , vol. 51, # 20 p. 6581 - 6591

2-Carboxybenzaldehyde structure

2-Carboxybenzal...

CAS#:119-67-5

~%

2-Methyl-2-propanyl 4-{2-fluoro-5-[(4-oxo-3,4-dihydro-1-phthalazi nyl)methyl]benzoyl}-1-piperazinecarboxylate Structure

2-Methyl-2-prop...

CAS#:763114-04-1

Literature: SHANGHAI DE NOVO PHARMATECH CO LTD.; GAO, Daxin Patent: WO2012/71684 A1, 2012 ; WO 2012/071684 A1

2-Fluoro-5-formylbenzonitrile structure

2-Fluoro-5-form...

CAS#:218301-22-5

~%

2-Methyl-2-propanyl 4-{2-fluoro-5-[(4-oxo-3,4-dihydro-1-phthalazi nyl)methyl]benzoyl}-1-piperazinecarboxylate Structure

2-Methyl-2-prop...

CAS#:763114-04-1

Literature: SHANGHAI DE NOVO PHARMATECH CO LTD.; GAO, Daxin Patent: WO2012/71684 A1, 2012 ; WO 2012/071684 A1

3-Bromo-4-fluorobenzaldehyde structure

3-Bromo-4-fluor...

CAS#:77771-02-9

~%

2-Methyl-2-propanyl 4-{2-fluoro-5-[(4-oxo-3,4-dihydro-1-phthalazi nyl)methyl]benzoyl}-1-piperazinecarboxylate Structure

2-Methyl-2-prop...

CAS#:763114-04-1

Literature: SHANGHAI DE NOVO PHARMATECH CO LTD.; GAO, Daxin Patent: WO2012/71684 A1, 2012 ; WO 2012/071684 A1

Dimethyl (3-oxo-1,3-dihydroisobenzofuran-1-yl)phosphonate structure

Dimethyl (3-oxo...

CAS#:61260-15-9

~%

2-Methyl-2-propanyl 4-{2-fluoro-5-[(4-oxo-3,4-dihydro-1-phthalazi nyl)methyl]benzoyl}-1-piperazinecarboxylate Structure

2-Methyl-2-prop...

CAS#:763114-04-1

Literature: SHANGHAI DE NOVO PHARMATECH CO LTD.; GAO, Daxin Patent: WO2012/71684 A1, 2012 ; WO 2012/071684 A1

2-fluoro-5-[(Z)-(3-oxo-2-benzofuran-1-ylidene)methyl]benzonitrile structure

2-fluoro-5-[(Z)...

CAS#:763114-25-6

~%

2-Methyl-2-propanyl 4-{2-fluoro-5-[(4-oxo-3,4-dihydro-1-phthalazi nyl)methyl]benzoyl}-1-piperazinecarboxylate Structure

2-Methyl-2-prop...

CAS#:763114-04-1

Literature: SHANGHAI DE NOVO PHARMATECH CO LTD.; GAO, Daxin Patent: WO2012/71684 A1, 2012 ; WO 2012/071684 A1

2-Fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)Methyl)benzonitrile structure

2-Fluoro-5-((4-...

CAS#:1021298-68-9

~%

2-Methyl-2-propanyl 4-{2-fluoro-5-[(4-oxo-3,4-dihydro-1-phthalazi nyl)methyl]benzoyl}-1-piperazinecarboxylate Structure

2-Methyl-2-prop...

CAS#:763114-04-1

Literature: SHANGHAI DE NOVO PHARMATECH CO LTD.; Gao, Daxin Patent: US2013/224107 A1, 2013 ;

Precursor 8
CAS#:763114-26-7 2-fluoro-5-((4-... CAS#:57260-71-6 N-Boc-piperazine CAS#:119-67-5 2-Carboxybenzal... CAS#:218301-22-5 2-Fluoro-5-form...
CAS#:77771-02-9 3-Bromo-4-fluor... CAS#:61260-15-9 Dimethyl (3-oxo... CAS#:763114-25-6 2-fluoro-5-[(Z)... CAS#:1021298-68-9 2-Fluoro-5-((4-...
DownStream 0

tert-butyl 4-(2-fluoro-5-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)benzoyl)piperazin-1-carboxylate

5-(4-tert-butoxycarbonyl-1-piperazinyl)benzofuran-2-carboxamide

4-[2-fluoro-5-(4-oxo-3,4-dihydro-phthalazin-1-ylmethyl)-benzoyl]-piperazine-1-carboxylic acid tert-butyl ester

tert-butyl 4-[2-fluoro-5-[(4-oxo-3H-phthalazin-1-yl)methyl]benzoyl]piperazine-1-carboxylate

Tert-butyl 4-(2-carbamoylbenzofuran-5-yl)piperazine-1-carboxylate

tert-butyl 4-[2-(aminocarbonyl)-1-benzofuran-5-yl]piperazine-1-carboxylate

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