N,N'-dibenzyl-N,N'-bis[(Z)-benzylideneamino]methanediamine

Formula:C29H28N4 Mutagenic:none Tumorigenic:none Reproductive Effective:none N,N'-dibenzyl-N,N'-bis[(Z)-benzylideneamino]methanediamine is not a drug-like molecule.

MolNameN,N'-dibenzyl-N,N'-bis[(Z)-benzylideneamino]methanediamine
MolecularFormulaC29H28N4
SmilesC(c1ccccc1)N(CN(Cc1ccccc1)/N=C\c1ccccc1)/N=C\c1ccccc1
InChIInChI=1S/C29H28N4/c1-5-13-26(14-6-1)21-30-32(23-28-17-9-3-10-18-28)25-33(24-29-19-11-4-12-20-29)31-22-27-15-7-2-8-16-27/h1-22H,23-25H2
InChIKSFCSLWUSEWVDOK-UHFFFAOYSA-N
TotalMolweight432.569
Molweight432.569
MonoisotopicMass432.231396
CLogP6.1672
CLogS-6.319
H Acceptors4
TotalSurfaceArea363.94
Relative PSA0.082761
PolarSurfaceArea31.2
Druglikeness4.4974
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsmethanediamine; imine/hydrazone of aldehyde
Shape Index0.45455
Fragments1
Non HAtoms33
NonCHAtoms4
Electronegative Atoms4
Rotatable Bond10
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms5
Symmetricatoms20
StereoCon

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