N,N'-bis[(Z)-(2-chlorophenyl)methylideneamino]pentanediamide

Formula:C19H18N4O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N,N'-bis[(Z)-(2-chlorophenyl)methylideneamino]pentanediamide is not a drug-like molecule.

MolNameN,N'-bis[(Z)-(2-chlorophenyl)methylideneamino]pentanediamide
MolecularFormulaC19H18N4O2Cl2
SmilesO=C(CCCC(N/N=C\c(cccc1)c1Cl)=O)N/N=C\c(cccc1)c1Cl
InChIInChI=1S/C19H18Cl2N4O2/c20-16-8-3-1-6-14(16)12-22-24-18(26)10-5-11-19(27)25-23-13-15-7-2-4-9-17(15)21/h1-4,6-9,12-13H,5,10-11H2,(H,24,26)(H,25,27)
InChIKMVUGBTCJOLGFMC-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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