Organofluorine / Alfa Chemistry
N-(3-(2-((2,3-Difluoro-4-(4-(2-hydroxyethyl)piperazin-1-yl)phenyl)amino)quinazolin-8-yl)phenyl)acrylamide

N-(3-(2-((2,3-Difluoro-4-(4-(2-hydroxyethyl)piperazin-1-yl)phenyl)amino)quinazolin-8-yl)phenyl)acrylamide

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N-(3-(2-((2,3-Difluoro-4-(4-(2-hydroxyethyl)piperazin-1-yl)phenyl)amino)quinazolin-8-yl)phenyl)acrylamide
Catalog OFC1660963427
CAS 1660963-42-7
Category Fluorinated Aromatic Alcohols and Phenols
Purity 97%
MDL Number MFCD30345533
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Chemical Data Computational Chemistry Health Safety
Molecular Formula C29H28F2N6O2
Molecular Weight 530.57
Molar Refractivity 155.31
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 1.0
Muegge 0.0
Veber 0.0
Consensus LogP 4.01
MLogP 3.11
SILICOS-IT 4.36
WLogP 4.45
XLogP3 4.26
iLogP 3.89
BBB Permeant No
CYP1A2 Inhibitor No
CYP2C19 Inhibitor Yes
CYP2C9 Inhibitor Yes
CYP2D6 Inhibitor Yes
CYP3A4 Inhibitor Yes
GI Absorption High
LogKp -6.51 cm/s
P-gp Substrate Yes
Fraction Csp3 0.21
GHS Pictogram GHS07
Hazard Statements H302-H315-H319-H335
Precautionary Statements P261-P305+P351+P338

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