N,N'-bis[(Z)-[(Z)-2-chloro-3-(4-nitrophenyl)prop-2-enylidene]amino]oxamide

Formula:C20H14N6O6Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N,N'-bis[(Z)-[(Z)-2-chloro-3-(4-nitrophenyl)prop-2-enylidene]amino]oxamide is not a drug-like molecule.

MolName	N,N'-bis[(Z)-[(Z)-2-chloro-3-(4-nitrophenyl)prop-2-enylidene]amino]oxamide
MolecularFormula	C20H14N6O6Cl2
Smiles	[O-][N+](c1ccc(/C=C(/C=N\NC(C(N/N=C\C(\Cl)=C\c(cc2)ccc2[N+]([O-])=O)=O)=O)\Cl)cc1)=O
InChI	InChI=1S/C20H14Cl2N6O6/c21-15(9-13-1-5-17(6-2-13)27(31)32)11-23-25-19(29)20(30)26-24-12-16(22)10-14-3-7-18(8-4-14)28(33)34/h1-12H,(H,25,29)(H,26,30)
InChIK	NPUXHQVKHMWTET-UHFFFAOYSA-N
TotalMolweight	505.273
Molweight	505.273
MonoisotopicMass	504.035188
CLogP	1.655
CLogS	-7.004
H Acceptors	12
H Donors	2
TotalSurfaceArea	368.56
Relative PSA	0.36048
PolarSurfaceArea	174.56
Druglikeness	-1.5705
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide
Shape Index	0.70588
Fragments	1
Non HAtoms	34
NonCHAtoms	14
Electronegative Atoms	14
Rotatable Bond	9
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	19
AcidicOxygens	2
StereoCon

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