Crystal Structure of Idelalisib t-BuOH monosolvate dihydrate

Id2242863
Common nameIdelalisib t-BuOH monosolvate dihydrate
Chemical name5-Fluoro-3-phenyl-2-[(1<i>S</i>)-1-(9<i>H</i>-purin-6-ylamino)propyl]quinazolin-4(3<i>H</i>)-one <i>tert</i>-butanol monosolvate dihydrate
a (Å)21.3758(6)
b (Å)9.2781(3)
c (Å)13.9722(5)
α (°)90
β (°)102.654(3)
γ (°)90
V (Å3)2703.75(15)
Space groupC 1 2 1
Temperature (K)173(2)
Rint0.0388