4-chloro-N-[(E)-[(2Z)-2-[(4-chlorobenzoyl)hydrazinylidene]ethylidene]amino]benzamide

Formula:C16H12N4O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:low 4-chloro-N-[(E)-[(2Z)-2-[(4-chlorobenzoyl)hydrazinylidene]ethylidene]amino]benzamide is a drug-like molecule.

MolName4-chloro-N-[(E)-[(2Z)-2-[(4-chlorobenzoyl)hydrazinylidene]ethylidene]amino]benzamide
MolecularFormulaC16H12N4O2Cl2
SmilesO=C(c(cc1)ccc1Cl)N/N=C/C=N\NC(c(cc1)ccc1Cl)=O
InChIInChI=1S/C16H12Cl2N4O2/c17-13-5-1-11(2-6-13)15(23)21-19-9-10-20-22-16(24)12-3-7-14(18)8-4-12/h1-10H,(H,21,23)(H,22,24)
InChIKVIACHDBFUACSJH-UHFFFAOYSA-N
TotalMolweight363.203
Molweight363.203
MonoisotopicMass362.03373
CLogP3.1286
CLogS-5.434
H Acceptors6
H Donors2
TotalSurfaceArea271.8
Relative PSA0.26497
PolarSurfaceArea82.92
Druglikeness4.4715
Mutagenicnone
Tumorigenicnone
Reproductive Effectivelow
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.75
Fragments1
Non HAtoms24
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond5
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Symmetricatoms4
StereoCon

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