(4Z)-2-(4-bromophenyl)-4-[[4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-1,3-oxazol-5-one

Formula:C23H15NO3BrF Mutagenic:none Tumorigenic:none Reproductive Effective:none (4Z)-2-(4-bromophenyl)-4-[[4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-1,3-oxazol-5-one is a drug-like molecule.

MolName(4Z)-2-(4-bromophenyl)-4-[[4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-1,3-oxazol-5-one
MolecularFormulaC23H15NO3BrF
SmilesO=C1OC(c(cc2)ccc2Br)=N/C1=C\c(cc1)ccc1OCc(cc1)ccc1F
InChIInChI=1S/C23H15BrFNO3/c24-18-7-5-17(6-8-18)22-26-21(23(27)29-22)13-15-3-11-20(12-4-15)28-14-16-1-9-19(25)10-2-16/h1-13H,14H2
InChIKYWTMZOZJNQRJHI-UHFFFAOYSA-N
TotalMolweight452.278
Molweight452.278
MonoisotopicMass451.021933
CLogP4.7659
CLogS-6.408
H Acceptors4
TotalSurfaceArea303.45
Relative PSA0.14681
PolarSurfaceArea47.89
Druglikeness-2.4229
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.68966
Fragments1
Non HAtoms29
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms3
Symmetricatoms6
StereoCon

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