2-benzyl-N,N'-bis[(Z)-(3-nitrophenyl)methylideneamino]propanediamide

Formula:C24H20N6O6 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-benzyl-N,N'-bis[(Z)-(3-nitrophenyl)methylideneamino]propanediamide is not a drug-like molecule.

MolName	2-benzyl-N,N'-bis[(Z)-(3-nitrophenyl)methylideneamino]propanediamide
MolecularFormula	C24H20N6O6
Smiles	[O-][N+](c1cccc(/C=N\NC(C(Cc2ccccc2)C(N/N=C\c2cccc([N+]([O-])=O)c2)=O)=O)c1)=O
InChI	InChI=1S/C24H20N6O6/c31-23(27-25-15-18-8-4-10-20(12-18)29(33)34)22(14-17-6-2-1-3-7-17)24(32)28-26-16-19-9-5-11-21(13-19)30(35)36/h1-13,15-16,22H,14H2,(H,27,31)(H,28,32)
InChIK	DRDGRRYUAJUXGQ-UHFFFAOYSA-N
TotalMolweight	488.459
Molweight	488.459
MonoisotopicMass	488.144434
CLogP	2.8098
CLogS	-6.603
H Acceptors	12
H Donors	2
TotalSurfaceArea	374.32
Relative PSA	0.35494
PolarSurfaceArea	174.56
Druglikeness	0.31997
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.52778
Fragments	1
Non HAtoms	36
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	10
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	4
Symmetricatoms	16
AcidicOxygens	2
StereoCon

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