Jagtap, Ajit Dhananjay published the artcile4-Substituted 2-amino-3,4-dihydroquinazolines with a 3-hairpin turn side chain as novel inhibitors of BACE-1, Recommanded Product: 1-Methylpyrazole, the publication is Bioorganic Chemistry (2020), 103135, database is CAplus and MEDLINE.
Herein, the authors report the identification, design, and synthesis of a series of 4-substituted 2-amino-3,4-dihydroquinazolines I [R1 = Me, CH:CH2, Bn, etc., R2 = Me, cyclopropyl, (1-methyl-1H-pyrazol-4-yl)methyl] with hairpin turn side chains as novel inhibitors of BACE-1. The dihydroquinazoline derivatives were rationally designed by modifying the amide group and relocating the α-hydrophobic substituent on the hairpin turn side chain of lead compound II to the C4-position on the 3,4-dihydroquinazoline scaffold to facilitate interactions with the S1, S2 and S1‘ subsites of BACE-1. Among these derivatives, two compounds exhibited potent BACE-1 inhibitory activity: 4-methyl-substituted derivative I [R1 = Me, R2 = (1-methyl-1H-pyrazol-4-yl)methyl] (BACE-1 CFA IC50 = 0.38μM; BACE-1 WCA IC50 = 0.14μM) and 4-cyclohexylmethyl-substituted derivative I [R1 = cyclohexylmethyl, R2 = (1-methyl-1H-pyrazol-4-yl)methyl] (BACE-1 CFA IC50 = 0.49μM; BACE-1 WCA IC50 = 0.14μM). The results suggest that the structural modifications maintain the hairpin turn topol. similar to that of compound II and provide an addnl. interaction with the S2 subsite.
Bioorganic Chemistry published new progress about 930-36-9. 930-36-9 belongs to pyrazoles-derivatives, auxiliary class Pyrazole, name is 1-Methylpyrazole, and the molecular formula is C4H6N2, Recommanded Product: 1-Methylpyrazole.
Referemce:
https://en.wikipedia.org/wiki/Pyrazole,
Pyrazoles – an overview | ScienceDirect Topics