N,N'-bis[(Z)-1,3-benzodioxol-5-ylmethylideneamino]hexanediamide

Formula:C22H22N4O6 Mutagenic:none Tumorigenic:none Reproductive Effective:none N,N'-bis[(Z)-1,3-benzodioxol-5-ylmethylideneamino]hexanediamide is a drug-like molecule.

MolName	N,N'-bis[(Z)-1,3-benzodioxol-5-ylmethylideneamino]hexanediamide
MolecularFormula	C22H22N4O6
Smiles	O=C(CCCCC(N/N=C\c(cc1)cc2c1OCO2)=O)N/N=C\c(cc1)cc2c1OCO2
InChI	InChI=1S/C22H22N4O6/c27-21(25-23-11-15-5-7-17-19(9-15)31-13-29-17)3-1-2-4-22(28)26-24-12-16-6-8-18-20(10-16)32-14-30-18/h5-12H,1-4,13-14H2,(H,25,27)(H,26,28)
InChIK	LEWJDXJCRAJFCX-UHFFFAOYSA-N
TotalMolweight	438.439
Molweight	438.439
MonoisotopicMass	438.153936
CLogP	4.5788
CLogS	-6.62
H Acceptors	10
H Donors	2
TotalSurfaceArea	336.52
Relative PSA	0.33288
PolarSurfaceArea	119.84
Druglikeness	-4.2769
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.6875
Fragments	1
Non HAtoms	32
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	9
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	10
Symmetricatoms	16
StereoCon

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