2-[4-chloro-2-[(Z)-2-(4-chlorophenyl)-2-cyanoethenyl]phenoxy]-N-(3,4-dichlorophenyl)acetamide

Formula:C23H14N2O2Cl4 Mutagenic:none Tumorigenic:low Reproductive Effective:high 2-[4-chloro-2-[(Z)-2-(4-chlorophenyl)-2-cyanoethenyl]phenoxy]-N-(3,4-dichlorophenyl)acetamide is not a drug-like molecule.

MolName2-[4-chloro-2-[(Z)-2-(4-chlorophenyl)-2-cyanoethenyl]phenoxy]-N-(3,4-dichlorophenyl)acetamide
MolecularFormulaC23H14N2O2Cl4
SmilesN#C/C(/c(cc1)ccc1Cl)=C\c(cc(cc1)Cl)c1OCC(Nc(cc1)cc(Cl)c1Cl)=O
InChIInChI=1S/C23H14Cl4N2O2/c24-17-3-1-14(2-4-17)16(12-28)9-15-10-18(25)5-8-22(15)31-13-23(30)29-19-6-7-20(26)21(27)11-19/h1-11H,13H2,(H,29,30)
InChIKITZQQCRHPGIIEP-UHFFFAOYSA-N
TotalMolweight492.188
Molweight492.188
MonoisotopicMass489.980936
CLogP6.479
CLogS-7.865
H Acceptors4
H Donors1
TotalSurfaceArea353.85
Relative PSA0.13582
PolarSurfaceArea62.12
Druglikeness-2.8977
Mutagenicnone
Tumorigeniclow
Reproductive Effectivehigh
Irritantnone
Nasty Functions
Shape Index0.58065
Fragments1
Non HAtoms31
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond6
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms2
Symmetricatoms2
Amides1
StereoCon

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