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2761063-99-2

2761063-99-2 Structure

2761063-99-2 Structure
IdentificationBack Directory
[Name]

Morpholine, 2-phenyl-4-[6-[[cis-3-(1H-pyrazol-1-yl)cyclobutyl]oxy]-4-pyrimidinyl]-, (2S)-
[CAS]

2761063-99-2
[Synonyms]

Morpholine, 2-phenyl-4-[6-[[cis-3-(1H-pyrazol-1-yl)cyclobutyl]oxy]-4-pyrimidinyl]-, (2S)-
[Molecular Formula]

C21H23N5O2
[MOL File]

2761063-99-2.mol
[Molecular Weight]

377.44
Chemical PropertiesBack Directory
[Boiling point ]

613.7±55.0 °C(Predicted)
[density ]

1.36±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO : 100 mg/mL (264.94 mM; Need ultrasonic)
[form ]

Oil
[pka]

5.85±0.26(Predicted)
[color ]

Colorless to light yellow
Hazard InformationBack Directory
[Uses]

ELOVL1-IN-3 (Compound 22) is a potent and orally active inhibitor of elongation of very long chain fatty acid 1 (ELOVL1) enzyme. ELOVL1-IN-3 serves as a useful tool for researching adrenoleukodystrophy (ALD)[1].
[Biological Activity]

ELOVL1-IN-3 (Compound 22) is a potent and orally active inhibitor of elongation of very long chain fatty acid 1 (ELOVL1) enzyme. ELOVL1-IN-3 serves as a useful tool for researching adrenoleukodystrophy (ALD)[1].
[in vivo]

ELOVL1-IN-3 (1-32 mg/kg, p.o., once daily, for 3 months) significantly reduced blood C26:0 lysophosphatidylcholine (LPC) levels in ABCD1 knockout C57BL/6 mice[1]. ELOVL1-IN-3 (10 or 50 mg/kg, p.o., once daily, for 28 days) significantly reduced blood C26:0 lysophosphatidylcholine (LPC) levels in Sprague-Dawley rats[1]. ELOVL1-IN-3 (6.5 or 50 mg/kg, p.o., once daily, for 14 days) significantly reduced blood C26:0 lysophosphatidylcholine (LPC) levels in cynomolgus monkeys[1].

Animal Model:ATP binding cassette transporter D1 (ABCD1) knockout mouse model (Adrenoleukodystrophy (ALD) disease)[1]
Dosage:1, 4, 8, 16, or 32 mg/kg
Administration:Oral gavage (p.o.), once daily for 3 months
Result:Significantly reduced blood C26:0 LPC levels (8 mg/kg or higher brought levels near wild-type).
Animal Model:Sprague-Dawley rats
Dosage:10 or 50 mg/kg
Administration:Oral gavage (p.o.), once daily for 28 days
Result:Reduced blood C26:0 LPC levels by 78% and 79%, respectively.
Animal Model:Cynomolgus monkey
Dosage:6.5 or 50 mg/kg
Administration:Oral gavage (p.o.), once daily for 14 days
Result:Reduced blood C26:0 LPC levels by 47% and 65%, respectively.
[storage]

Store at -20°C
[References]

[1]. Boyd MJ, et al. Discovery of Novel, Orally Bioavailable Pyrimidine Ether-Based Inhibitors of ELOVL1. J Med Chem. 2021;64(24):17777-17794.
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