F5955-0065
Product ID: F5955-0065
Collection: Screening compounds, Building blocks
C15H15FN6O
CAS RN1251578-67-2FormulaC15H15FN6OPurity95%Statesolid
IUPAC nameN-(4-fluorophenyl)-6-(morpholin-4-yl)-9H-purin-2-amine
SMILESFc1ccc(Nc2nc(N3CCOCC3)c3nc[nH]c3n2)cc1
InChiInChI=1S/C15H15FN6O/c16-10-1-3-11(4-2-10)19-15-20-13-12(17-9-18-13)14(21-15)22-5-7-23-8-6-22/h1-4,9H,5-8H2,(H2,17,18,19,20,21)
InChi KeyKPXPXKOSEYWROL-UHFFFAOYSA-N
MW314.32 [46.07...1702.72]
radaChart
Fsp30.27 [0...1.00]
cLogP2.45 [-11.42...28.50]
cLogSw-4.81 [-19.49...5.44]
TPSA78.96 [0...519.07]
HBD4 [0...10]
HBA6 [0...28]
ROTB3 [0...72]
AROM3 [0...16]
DL0.77 [0.02...0.95]
UA stock: 10507.2 mg
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