Organofluorine / Alfa Chemistry
(S)-N-(2-(2-Cyano-4,4-difluoropyrrolidin-1-yl)-2-oxoethyl)quinoline-4-carboxamide

(S)-N-(2-(2-Cyano-4,4-difluoropyrrolidin-1-yl)-2-oxoethyl)quinoline-4-carboxamide

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(S)-N-(2-(2-Cyano-4,4-difluoropyrrolidin-1-yl)-2-oxoethyl)quinoline-4-carboxamide
Catalog OFC1448440525
CAS 1448440-52-5
Category Fluorinated Amides
Synonyms SP-13786
Purity 97%
MDL Number MFCD29477499
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Chemical Data Computational Chemistry Health Safety
Molecular Formula C17H14F2N4O2
Molecular Weight 344.32
Molar Refractivity 88.37
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 0.0
Veber 0.0
Consensus LogP 1.61
MLogP 0.79
SILICOS-IT 2.14
WLogP 2.18
XLogP3 1.62
iLogP 1.33
BBB Permeant No
CYP1A2 Inhibitor No
CYP2C19 Inhibitor Yes
CYP2C9 Inhibitor No
CYP2D6 Inhibitor No
CYP3A4 Inhibitor No
GI Absorption High
LogKp -7.25 cm/s
P-gp Substrate No
Fraction Csp3 0.29
GHS Pictogram GHS07
Hazard Statements H302-H315-H319-H335
Precautionary Statements P261-P305+P351+P338

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