N'-[(Z)-(4-cyanophenyl)methylideneamino]-N-(2,4-dichlorophenyl)butanediamide

Formula:C18H14N4O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N'-[(Z)-(4-cyanophenyl)methylideneamino]-N-(2,4-dichlorophenyl)butanediamide is a drug-like molecule.

MolName	N'-[(Z)-(4-cyanophenyl)methylideneamino]-N-(2,4-dichlorophenyl)butanediamide
MolecularFormula	C18H14N4O2Cl2
Smiles	N#Cc1ccc(/C=N\NC(CCC(Nc(ccc(Cl)c2)c2Cl)=O)=O)cc1
InChI	InChI=1S/C18H14Cl2N4O2/c19-14-5-6-16(15(20)9-14)23-17(25)7-8-18(26)24-22-11-13-3-1-12(10-21)2-4-13/h1-6,9,11H,7-8H2,(H,23,25)(H,24,26)
InChIK	AWRPTUPJBNLORN-UHFFFAOYSA-N
TotalMolweight	389.241
Molweight	389.241
MonoisotopicMass	388.04938
CLogP	4.1003
CLogS	-6.31
H Acceptors	6
H Donors	2
TotalSurfaceArea	296.27
Relative PSA	0.25001
PolarSurfaceArea	94.35
Druglikeness	-0.6588
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.73077
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	2
Amides	1
StereoCon

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