N,N'-bis[(Z)-(3-chlorophenyl)methylideneamino]pentanediamide

Formula:C19H18N4O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N,N'-bis[(Z)-(3-chlorophenyl)methylideneamino]pentanediamide is not a drug-like molecule.

MolNameN,N'-bis[(Z)-(3-chlorophenyl)methylideneamino]pentanediamide
MolecularFormulaC19H18N4O2Cl2
SmilesO=C(CCCC(N/N=C\c1cccc(Cl)c1)=O)N/N=C\c1cc(Cl)ccc1
InChIInChI=1S/C19H18Cl2N4O2/c20-16-6-1-4-14(10-16)12-22-24-18(26)8-3-9-19(27)25-23-13-15-5-2-7-17(21)11-15/h1-2,4-7,10-13H,3,8-9H2,(H,24,26)(H,25,27)
InChIKSRZDURLEHFQXCO-UHFFFAOYSA-N
TotalMolweight405.284
Molweight405.284
MonoisotopicMass404.08068
CLogP5.1136
CLogS-6.4
H Acceptors6
H Donors2
TotalSurfaceArea313.08
Relative PSA0.23004
PolarSurfaceArea82.92
Druglikeness-1.223
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.7037
Fragments1
Non HAtoms27
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond8
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms3
Symmetricatoms13
StereoCon

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