N-(1,3-benzodioxol-5-ylmethyl)-N'-[(Z)-[2-[2-(benzylamino)-2-oxoethoxy]phenyl]methylideneamino]oxamide

Formula:C26H24N4O6 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-(1,3-benzodioxol-5-ylmethyl)-N'-[(Z)-[2-[2-(benzylamino)-2-oxoethoxy]phenyl]methylideneamino]oxamide is a drug-like molecule.

MolName	N-(1,3-benzodioxol-5-ylmethyl)-N'-[(Z)-[2-[2-(benzylamino)-2-oxoethoxy]phenyl]methylideneamino]oxamide
MolecularFormula	C26H24N4O6
Smiles	O=C(COc1c(/C=N\NC(C(NCc(cc2)cc3c2OCO3)=O)=O)cccc1)NCc1ccccc1
InChI	InChI=1S/C26H24N4O6/c31-24(27-13-18-6-2-1-3-7-18)16-34-21-9-5-4-8-20(21)15-29-30-26(33)25(32)28-14-19-10-11-22-23(12-19)36-17-35-22/h1-12,15H,13-14,16-17H2,(H,27,31)(H,28,32)(H,30,33)
InChIK	YCLSPHQCNXORKZ-UHFFFAOYSA-N
TotalMolweight	488.499
Molweight	488.499
MonoisotopicMass	488.169586
CLogP	2.3965
CLogS	-5.16
H Acceptors	10
H Donors	3
TotalSurfaceArea	376.71
Relative PSA	0.3053
PolarSurfaceArea	127.35
Druglikeness	3.8355
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide
Shape Index	0.63889
Fragments	1
Non HAtoms	36
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	10
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	7
Symmetricatoms	2
Amides	2
StereoCon

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