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709-85-3

709-85-3 Structure

709-85-3 Structure
IdentificationBack Directory
[Name]

Benzenemethanamine, 4-bromo-N-methyl-N-2-propyn-1-yl-
[CAS]

709-85-3
[Synonyms]

PYCR1-IN-1
N-(4-bromobenzyl)-N-methylprop-2-yn-1-amine
(4-bromophenyl)methyl](methyl)(prop-2-yn-1-yl)amine
Benzenemethanamine, 4-bromo-N-methyl-N-2-propyn-1-yl-
[Molecular Formula]

C11H12BrN
[MDL Number]

MFCD14645242
[MOL File]

709-85-3.mol
[Molecular Weight]

238.12
Chemical PropertiesBack Directory
[Boiling point ]

287.0±20.0 °C(Predicted)
[density ]

1.330±0.06 g/cm3(Predicted)
[form ]

Liquid
[pka]

6.27±0.50(Predicted)
[color ]

Colorless to light yellow
Hazard InformationBack Directory
[Uses]

PYCR1-IN-1 (compound 4) is a pyrroline-5-carboxylate reductase 1 (PYCR1) inhibitor with an IC50 of 8.8 μM. PYCR1-IN-1 has anticancer effects[1].
[References]

[1] Kirsty Milne, et al. A fragment-like approach to PYCR1 inhibition. Bioorg Med Chem Lett. 2019 Sep 15;29(18):2626-2631. DOI:10.1016/j.bmcl.2019.07.047
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