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C20H18N4O4Cl2 | Cheminformatics

N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-[2-(morpholine-4-carbonyl)phenyl]oxamide

Molecular Formula : C20H18N4O4Cl2 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |
N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-[2-(morpholine-4-carbonyl)phenyl]oxamide is a drug-like molecule.

MolName : N'-[(Z)-(2,4-dichlorophenyl)methylideneamino]-N-[2-(morpholine-4-carbonyl)phenyl]oxamide

MolecularFormula : C20H18N4O4Cl2

Smiles : O=C(C(N/N=C\c(ccc(Cl)c1)c1Cl)=O)Nc(cccc1)c1C(N1CCOCC1)=O

InChI : InChI=1S/C20H18Cl2N4O4/c21-14-6-5-13(16(22)11-14)12-23-25-19(28)18(27)24-17-4-2-1-3-15(17)20(29)26-7-9-30-10-8-26/h1-6,11-12H,7-10H2,(H,24,27)(H,25,28)

InChIK : IDGLQGNZWYSELP-UHFFFAOYSA-N

TotalMolweight : 449.293

Molweight : 449.293

MonoisotopicMass : 448.07051

CLogP : 3.0302

CLogS : -4.707

H Acceptors : 8

H Donors : 2

TotalSurfaceArea : 326.63

Relative PSA : 0.26666

PolarSurfaceArea : 100.1

Druglikeness : 5.0313

Mutagenic : none

Tumorigenic : none

Reproductive Effective : none

Irritant : none

Nasty Functions : acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide

Shape Index : 0.6

Fragments : 1

Non HAtoms : 30

NonCHAtoms : 10

Electronegative Atoms : 10

Rotatable Bond : 5

Rings Closures : 3

Small Rings : 3

Aromatic Rings : 2

Aromatic Atoms : 12

Sp3Atoms : 5

Symmetricatoms : 2

Amides : 2

StereoCon :

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