Piperazine-2,6-dione - CAS 4774-22-5

Catalog:	BB026381
Product Name:	Piperazine-2,6-dione
CAS:	4774-22-5
Synonyms:	piperazine-2,6-dione; piperazine-2,6-dione

Technical Data

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Computed Properties

IUPAC Name:	piperazine-2,6-dione
Description:	Piperazine-2,6-dione (CAS# 4774-22-5) is useful for the prevention or treatment of apoptosis.
Molecular Weight:	114.10
Molecular Formula:	C4H6N2O2
Canonical SMILES:	C1C(=O)NC(=O)CN1
InChI:	InChI=1S/C4H6N2O2/c7-3-1-5-2-4(8)6-3/h5H,1-2H2,(H,6,7,8)
InChI Key:	CYJAWBVQRMVFEO-UHFFFAOYSA-N
Appearance:	Solid
MDL:	MFCD11109779
LogP:	-1.11000

Publication Number	Title	Priority Date
US-2016122336-A1	TRIFLUOROMETHYL ALCOHOLS AS MODULATORS OF RORyt	20141030
US-2015284383-A1	Indole derivatives and use thereof	20140407
WO-2015131005-A1	9h-pyrimido[4,5-b]indoles and related analogs as bet bromodomain inhibitors	20140228
WO-2015114395-A1	Process for the preparation of vortioxetine salts	20140131
WO-2015103489-A1	Heteroatom containing deoxyuridine triphosphatase inhibitors	20140103

PMID	Publication Date	Title	Journal
22412499	20120301	2-[3,5-Dioxo-4-(pyridin-3-yl)piperazin-1-yl]acetic acid	Acta crystallographica. Section E, Structure reports online
22178094	20120201	Synthesis and anticonvulsant activity of novel 2,6-diketopiperazine derivatives. Part 2: Perhydropyrido[1,2-a]pyrazines	European journal of medicinal chemistry
21862182	20111001	Synthesis and anticonvulsant activity of novel 2,6-diketopiperazine derivatives. Part 1: perhydropyrrole[1,2-a]pyrazines	European journal of medicinal chemistry
21542562	20110728	Novel lipophilic acetohydroxamic acid derivatives based on conformationally constrained spiro carbocyclic 2,6-diketopiperazine scaffolds with potent trypanocidal activity	Journal of medicinal chemistry
19610669	20090825	Synthesis and spectral and chemical properties of the yellow fluorescent protein zFP538 chromophore	Biochemistry

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Complexity:	118
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	114.042927438
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	114.042927438
Rotatable Bond Count:	0
Topological Polar Surface Area:	58.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-1.3