Organofluorine / Alfa Chemistry
(S)-2-(1-((9H-Purin-6-yl)amino)propyl)-3-(3-fluorophenyl)-4H-chromen-4-one

(S)-2-(1-((9H-Purin-6-yl)amino)propyl)-3-(3-fluorophenyl)-4H-chromen-4-one

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(S)-2-(1-((9H-Purin-6-yl)amino)propyl)-3-(3-fluorophenyl)-4H-chromen-4-one
Catalog OFC1639417530
CAS 1639417-53-0
Category Fluorinated Ketones
Synonyms Tenalisib
Purity >95%
MDL Number MFCD28502205
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Chemical Data Computational Chemistry Health Safety
Molecular Formula C23H18FN5O2
Molecular Weight 415.42
Molar Refractivity 116.53
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 0.0
Veber 0.0
Consensus LogP 3.83
MLogP 2.4
SILICOS-IT 4.96
WLogP 4.73
XLogP3 4.21
iLogP 2.87
BBB Permeant No
CYP1A2 Inhibitor No
CYP2C19 Inhibitor No
CYP2C9 Inhibitor Yes
CYP2D6 Inhibitor Yes
CYP3A4 Inhibitor Yes
GI Absorption High
LogKp -5.84 cm/s
P-gp Substrate Yes
Fraction Csp3 0.13
GHS Pictogram GHS07
Hazard Statements H302-H315-H319-H335
Precautionary Statements P261-P305+P351+P338

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