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ChemicalBook--->CAS DataBase List--->852391-15-2

852391-15-2

852391-15-2 Structure

852391-15-2 Structure
IdentificationBack Directory
[Name]

5-((7-Cl-1H-indol-3-yl)Methyl)-3-MethyliMidazolidine-2,4-dione)
[CAS]

852391-15-2
[Synonyms]

Nec-1s
CS-2815
Nec-1s(7-Cl-O-Nec1)
Necrostatin-2 raceMate
Necrostatin 2 (raceMate)
RIP1 Inhibitor II, 7-Cl-O-Nec-1 - Calbiochem
5-((7-Cl-1H-indol-3-yl)Methyl)-3-MethyliMidazolidine-2,4-dione)
5-((7-Chloro-1H-indol-3-yl)methyl)-3-methylimidazolidine-2,4-dione
5-[(7-Chloro-1H-indol-3-yl)methyl]-3-methyl-2,4-imidazolidinedione
2,4-IMidazolidinedione, 5-[(7-chloro-1H-indol-3-yl)Methyl]-3-Methyl-
[Molecular Formula]

C13H12ClN3O2
[MDL Number]

MFCD19443135
[MOL File]

852391-15-2.mol
[Molecular Weight]

277.706
Chemical PropertiesBack Directory
[Melting point ]

173-175℃
[density ]

1.450±0.06 g/cm3(Predicted)
[storage temp. ]

+2C to +8C
[solubility ]

Soluble in DMSO (up to 25 mg/ml).
[form ]

Off-white to pale yellow solid
[pka]

8.48±0.70(Predicted)
[color ]

Off-white
[Stability:]

Stable for 1 year from date of purchase as supplied. Solutions in DMSO may be stored at -20° for up to 3 months.
Hazard InformationBack Directory
[Description]

7-Cl-O-Nec1 (852391-15-2) is a necrostatin-1 (Cat.# 10-1162) analogue with superior potency (IC50?= 206nM vs 494nM), selectivity and metabolic stability in blocking RIP1.1,2?7-Cl-O-Nec1 shows no off-target inhibition of indolamine-2,3-deoxygenase (IDO) in contrast to Necrostatin-1 (Nec-1).3,4?7-Cl-O-Nec1 showed higher activity in inhibiting necroptosis in Jurkat cells than Necrostatin-1 (EC50?= 210 nM vs. EC50?= 490 nM), no non-specific cytotoxicity at high concentrations (100 μM) and reasonable pharmacokinetic characteristics when used in mice.2?7-Cl-O-Nec1 is recommended for cellular and?in vivo?use over Necrostatin-1.5
[Uses]

Necrostatin 1s is an inhibitor of indolamine 2,3-deoxygenase. Necrostatin 1s is a neuroprotective with potential therapeutic functions against brain ischemia.
[storage]

Store at -20°C
[References]

1) Degterev?et al. (2005)?Chemical inhibitor of nonapoptotic cell death with therapeutic potential for ischemic brain injury; Nat. Chem. Biol.,?1?112 2) Teng?et al. (2005)?Structure-activity relationship of novel necroptosis inhibitors; Bioorg. Med. Chem. Lett.,?15?5039 3) Degterev?et al. (2012)?Activity and specificity of necrostatin-1, small-molecule inhibitor of RIP1 kinase; Cell Death Differ.,?20?366 4) Takahashi?et al. (2012)?Necrostatin-1 analogues: critical issues on the specificity, activity and in vivo use in experimental disease models; Cell Death Dis.,?3?e437 5) Degterev?et al. (2013)?Addendum: Chemical inhibitor of nonapoptotic cell death with therapeutic potential for ischemic brain injury; Nat. Chem. Biol.,?9?192
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