(4Z)-4-[[4-[bis(2-fluoroethyl)amino]phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one

Formula:C20H18N2O2F2 Mutagenic:high Tumorigenic:low Reproductive Effective:none (4Z)-4-[[4-[bis(2-fluoroethyl)amino]phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one is a drug-like molecule.

MolName(4Z)-4-[[4-[bis(2-fluoroethyl)amino]phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one
MolecularFormulaC20H18N2O2F2
SmilesO=C1OC(c2ccccc2)=N/C1=C\c(cc1)ccc1N(CCF)CCF
InChIInChI=1S/C20H18F2N2O2/c21-10-12-24(13-11-22)17-8-6-15(7-9-17)14-18-20(25)26-19(23-18)16-4-2-1-3-5-16/h1-9,14H,10-13H2
InChIKFSQFBBSRBVYEAT-UHFFFAOYSA-N
TotalMolweight356.371
Molweight356.371
MonoisotopicMass356.133634
CLogP2.8496
CLogS-4.705
H Acceptors4
TotalSurfaceArea272.99
Relative PSA0.13957
PolarSurfaceArea41.9
Druglikeness1.5895
Mutagenichigh
Tumorigeniclow
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.61538
Fragments1
Non HAtoms26
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond7
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms5
Symmetricatoms7
Amines1
Aromatic Amines1
StereoCon

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