(E)-N,N'-bis(3,5-dichlorophenyl)but-2-enediamide

Formula:C16H10N2O2Cl4 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N,N'-bis(3,5-dichlorophenyl)but-2-enediamide is a drug-like molecule.

MolName	(E)-N,N'-bis(3,5-dichlorophenyl)but-2-enediamide
MolecularFormula	C16H10N2O2Cl4
Smiles	O=C(/C=C/C(Nc1cc(Cl)cc(Cl)c1)=O)Nc1cc(Cl)cc(Cl)c1
InChI	InChI=1S/C16H10Cl4N2O2/c17-9-3-10(18)6-13(5-9)21-15(23)1-2-16(24)22-14-7-11(19)4-12(20)8-14/h1-8H,(H,21,23)(H,22,24)
InChIK	HFWAEZOITMADBC-UHFFFAOYSA-N
TotalMolweight	404.079
Molweight	404.079
MonoisotopicMass	401.949636
CLogP	4.83
CLogS	-6.188
H Acceptors	4
H Donors	2
TotalSurfaceArea	279.62
Relative PSA	0.17524
PolarSurfaceArea	58.2
Druglikeness	-0.23164
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.58333
Fragments	1
Non HAtoms	24
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Symmetricatoms	15
Amides	2
StereoCon

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