2-[4-[(Z)-2-(4-bromophenyl)-2-cyanoethenyl]-2-chlorophenoxy]-N-(2-fluorophenyl)acetamide

Formula:C23H15N2O2BrClF Mutagenic:none Tumorigenic:low Reproductive Effective:high 2-[4-[(Z)-2-(4-bromophenyl)-2-cyanoethenyl]-2-chlorophenoxy]-N-(2-fluorophenyl)acetamide is not a drug-like molecule.

MolName2-[4-[(Z)-2-(4-bromophenyl)-2-cyanoethenyl]-2-chlorophenoxy]-N-(2-fluorophenyl)acetamide
MolecularFormulaC23H15N2O2BrClF
SmilesN#C/C(/c(cc1)ccc1Br)=C\c(cc1)cc(Cl)c1OCC(Nc(cccc1)c1F)=O
InChIInChI=1S/C23H15BrClFN2O2/c24-18-8-6-16(7-9-18)17(13-27)11-15-5-10-22(19(25)12-15)30-14-23(29)28-21-4-2-1-3-20(21)26/h1-12H,14H2,(H,28,29)
InChIKOGAZXFRNTXKYQE-UHFFFAOYSA-N
TotalMolweight485.739
Molweight485.739
MonoisotopicMass483.998944
CLogP5.487
CLogS-6.805
H Acceptors4
H Donors1
TotalSurfaceArea332.57
Relative PSA0.14451
PolarSurfaceArea62.12
Druglikeness-6.0277
Mutagenicnone
Tumorigeniclow
Reproductive Effectivehigh
Irritantnone
Nasty Functions
Shape Index0.63333
Fragments1
Non HAtoms30
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond6
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms2
Symmetricatoms2
Amides1
StereoCon

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