1-N,4-N-bis[(Z)-(2-chlorophenyl)methylideneamino]benzene-1,4-dicarboxamide

Formula:C22H16N4O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 1-N,4-N-bis[(Z)-(2-chlorophenyl)methylideneamino]benzene-1,4-dicarboxamide is not a drug-like molecule.

MolName1-N,4-N-bis[(Z)-(2-chlorophenyl)methylideneamino]benzene-1,4-dicarboxamide
MolecularFormulaC22H16N4O2Cl2
SmilesO=C(c(cc1)ccc1C(N/N=C\c(cccc1)c1Cl)=O)N/N=C\c(cccc1)c1Cl
InChIInChI=1S/C22H16Cl2N4O2/c23-19-7-3-1-5-17(19)13-25-27-21(29)15-9-11-16(12-10-15)22(30)28-26-14-18-6-2-4-8-20(18)24/h1-14H,(H,27,29)(H,28,30)
InChIKZEUCPYISHYQQRJ-UHFFFAOYSA-N
TotalMolweight439.301
Molweight439.301
MonoisotopicMass438.06503
CLogP5.9556
CLogS-7.298
H Acceptors6
H Donors2
TotalSurfaceArea331.56
Relative PSA0.21722
PolarSurfaceArea82.92
Druglikeness4.4715
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.66667
Fragments1
Non HAtoms30
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond6
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Symmetricatoms16
StereoCon

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