4-(2-anilino-2-oxoethoxy)-N-[(Z)-(3,4-dichlorophenyl)methylideneamino]benzamide

Formula:C22H17N3O3Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-(2-anilino-2-oxoethoxy)-N-[(Z)-(3,4-dichlorophenyl)methylideneamino]benzamide is not a drug-like molecule.

MolName	4-(2-anilino-2-oxoethoxy)-N-[(Z)-(3,4-dichlorophenyl)methylideneamino]benzamide
MolecularFormula	C22H17N3O3Cl2
Smiles	O=C(COc(cc1)ccc1C(N/N=C\c(cc1)cc(Cl)c1Cl)=O)Nc1ccccc1
InChI	InChI=1S/C22H17Cl2N3O3/c23-19-11-6-15(12-20(19)24)13-25-27-22(29)16-7-9-18(10-8-16)30-14-21(28)26-17-4-2-1-3-5-17/h1-13H,14H2,(H,26,28)(H,27,29)
InChIK	LRQAUPPAKSUGRD-UHFFFAOYSA-N
TotalMolweight	442.301
Molweight	442.301
MonoisotopicMass	441.064696
CLogP	5.136
CLogS	-6.485
H Acceptors	6
H Donors	2
TotalSurfaceArea	330.56
Relative PSA	0.2133
PolarSurfaceArea	79.79
Druglikeness	4.7007
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.7
Fragments	1
Non HAtoms	30
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	4
Amides	1
StereoCon

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