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C17H15N2O4Cl | Cheminformatics
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2-(4-chlorophenoxy)-N-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]acetamide

Molecular Formula : C17H15N2O4Cl | Mutagenic : none | Tumorigenic : none | Reproductive Effective : high |
2-(4-chlorophenoxy)-N-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]acetamide is a drug-like molecule.

MolName : 2-(4-chlorophenoxy)-N-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]acetamide

MolecularFormula : C17H15N2O4Cl

Smiles : O=C(COc(cc1)ccc1Cl)N/N=C\c(cc1)cc2c1OCCO2

InChI : InChI=1S/C17H15ClN2O4/c18-13-2-4-14(5-3-13)24-11-17(21)20-19-10-12-1-6-15-16(9-12)23-8-7-22-15/h1-6,9-10H,7-8,11H2,(H,20,21)

InChIK : IKMHZACELHTCHM-UHFFFAOYSA-N

TotalMolweight : 346.769

Molweight : 346.769

MonoisotopicMass : 346.072035

CLogP : 3.3613

CLogS : -4.419

H Acceptors : 6

H Donors : 1

TotalSurfaceArea : 260.19

Relative PSA : 0.2537

PolarSurfaceArea : 69.15

Druglikeness : -2.6522

Mutagenic : none

Tumorigenic : none

Reproductive Effective : high

Irritant : none

Nasty Functions : acyl-hydrazone; imine/hydrazone of aldehyde

Shape Index : 0.70833

Fragments : 1

Non HAtoms : 24

NonCHAtoms : 7

Electronegative Atoms : 7

Rotatable Bond : 5

Rings Closures : 3

Small Rings : 3

Aromatic Rings : 2

Aromatic Atoms : 12

Sp3Atoms : 6

Symmetricatoms : 2

StereoCon :

Click to Load Molecule:
1 - 2-(4-chlorophenoxy)-N-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]acetamide
2 - 2-(4-chlorophenoxy)-N-[(Z)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]acetamide
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