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N-[(Z)-(4-chlorophenyl)methylideneamino]-2-[[2-[(2Z)-2-[(4-chlorophenyl)methylidene]hydrazinyl]-2-oxoethyl]-nitrosoamino]acetamide

Formula:C18H16N6O3Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(Z)-(4-chlorophenyl)methylideneamino]-2-[[2-[(2Z)-2-[(4-chlorophenyl)methylidene]hydrazinyl]-2-oxoethyl]-nitrosoamino]acetamide is a drug-like molecule.
MolNameN-[(Z)-(4-chlorophenyl)methylideneamino]-2-[[2-[(2Z)-2-[(4-chlorophenyl)methylidene]hydrazinyl]-2-oxoethyl]-nitrosoamino]acetamide
MolecularFormulaC18H16N6O3Cl2
SmilesO=C(CN(CC(N/N=C\c(cc1)ccc1Cl)=O)N=O)N/N=C\c(cc1)ccc1Cl
InChIInChI=1S/C18H16Cl2N6O3/c19-15-5-1-13(2-6-15)9-21-23-17(27)11-26(25-29)12-18(28)24-22-10-14-3-7-16(20)8-4-14/h1-10H,11-12H2,(H,23,27)(H,24,28)
InChIKWHUAAKATOFVDKO-UHFFFAOYSA-N
TotalMolweight435.27
Molweight435.27
MonoisotopicMass434.066093
CLogP3.4482
CLogS-5.008
H Acceptors9
H Donors2
TotalSurfaceArea327.42
Relative PSA0.30578
PolarSurfaceArea115.59
Druglikeness5.0192
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Nasty Functionsnitroso; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.72414
Fragments1
Non HAtoms29
NonCHAtoms11
Electronegative Atoms11
Rotatable Bond8
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms15
StereoCon

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