(Z)-2,2,2-trifluoro-1-phenyl-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylethanimine

Formula:C21H14N3F3S Mutagenic:none Tumorigenic:none Reproductive Effective:high (Z)-2,2,2-trifluoro-1-phenyl-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylethanimine is a drug-like molecule.

MolName(Z)-2,2,2-trifluoro-1-phenyl-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylethanimine
MolecularFormulaC21H14N3F3S
SmilesFC(/C(/c1ccccc1)=N\Sc1c(-c2ccccc2)nc2n1cccc2)(F)F
InChIInChI=1S/C21H14F3N3S/c22-21(23,24)19(16-11-5-2-6-12-16)26-28-20-18(15-9-3-1-4-10-15)25-17-13-7-8-14-27(17)20/h1-14H
InChIKSZWFRWPBYPGIMK-UHFFFAOYSA-N
TotalMolweight397.423
Molweight397.423
MonoisotopicMass397.086051
CLogP4.9488
CLogS-8.379
H Acceptors3
TotalSurfaceArea286.71
Relative PSA0.16714
PolarSurfaceArea54.96
Druglikeness-7.7435
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functions
Shape Index0.46429
Fragments1
Non HAtoms28
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms21
Sp3Atoms2
Symmetricatoms6
Aromatic Nitrogens2
BasicNitrogens2
StereoCon

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