N-(2-bromophenyl)-N'-[(Z)-[4-[2-(2-chloroanilino)-2-oxoethoxy]phenyl]methylideneamino]oxamide

Formula:C23H18N4O4BrCl Mutagenic:none Tumorigenic:none Reproductive Effective:none N-(2-bromophenyl)-N'-[(Z)-[4-[2-(2-chloroanilino)-2-oxoethoxy]phenyl]methylideneamino]oxamide is not a drug-like molecule.

MolName	N-(2-bromophenyl)-N'-[(Z)-[4-[2-(2-chloroanilino)-2-oxoethoxy]phenyl]methylideneamino]oxamide
MolecularFormula	C23H18N4O4BrCl
Smiles	O=C(COc1ccc(/C=N\NC(C(Nc(cccc2)c2Br)=O)=O)cc1)Nc(cccc1)c1Cl
InChI	InChI=1S/C23H18BrClN4O4/c24-17-5-1-3-7-19(17)28-22(31)23(32)29-26-13-15-9-11-16(12-10-15)33-14-21(30)27-20-8-4-2-6-18(20)25/h1-13H,14H2,(H,27,30)(H,28,31)(H,29,32)
InChIK	ZLIKGQXKRZUAMA-UHFFFAOYSA-N
TotalMolweight	529.777
Molweight	529.777
MonoisotopicMass	528.019994
CLogP	4.1975
CLogS	-6.387
H Acceptors	8
H Donors	3
TotalSurfaceArea	362.98
Relative PSA	0.26175
PolarSurfaceArea	108.89
Druglikeness	1.7854
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide
Shape Index	0.66667
Fragments	1
Non HAtoms	33
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	2
Amides	2
StereoCon

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1 - N-(2-bromophenyl)-N'-[(Z)-[4-[2-(2-chloroanilino)-2-oxoethoxy]phenyl]methylideneamino]oxamide | 2 - N-(2-bromophenyl)-N'-[(Z)-[4-[2-(2-chloroanilino)-2-oxoethoxy]phenyl]methylideneamino]oxamide

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