1,4-bis[(E)-2-[4-(difluoromethoxy)phenyl]ethenyl]benzene

Formula:C24H18O2F4 Mutagenic:low Tumorigenic:none Reproductive Effective:high 1,4-bis[(E)-2-[4-(difluoromethoxy)phenyl]ethenyl]benzene is not a drug-like molecule.

MolName1,4-bis[(E)-2-[4-(difluoromethoxy)phenyl]ethenyl]benzene
MolecularFormulaC24H18O2F4
SmilesFC(Oc1ccc(/C=C/c2ccc(/C=C/c(cc3)ccc3OC(F)F)cc2)cc1)F
InChIInChI=1S/C24H18F4O2/c25-23(26)29-21-13-9-19(10-14-21)7-5-17-1-2-18(4-3-17)6-8-20-11-15-22(16-12-20)30-24(27)28/h1-16,23-24H
InChIKCWSUAICYQNMXCQ-UHFFFAOYSA-N
TotalMolweight414.397
Molweight414.397
MonoisotopicMass414.124292
CLogP6.4124
CLogS-7.132
H Acceptors2
TotalSurfaceArea316.18
Relative PSA0.063255
PolarSurfaceArea18.46
Druglikeness-4.2075
Mutageniclow
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functions
Shape Index0.73333
Fragments1
Non HAtoms30
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond8
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms4
Symmetricatoms19
StereoCon

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