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C18H11N2O2Cl2F | Cheminformatics
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2,4-dichloro-N-[(Z)-[5-(4-fluorophenyl)furan-2-yl]methylideneamino]benzamide

Molecular Formula : C18H11N2O2Cl2F | Mutagenic : high | Tumorigenic : high | Reproductive Effective : none |
2,4-dichloro-N-[(Z)-[5-(4-fluorophenyl)furan-2-yl]methylideneamino]benzamide is not a drug-like molecule.

MolName : 2,4-dichloro-N-[(Z)-[5-(4-fluorophenyl)furan-2-yl]methylideneamino]benzamide

MolecularFormula : C18H11N2O2Cl2F

Smiles : O=C(c(ccc(Cl)c1)c1Cl)N/N=C\c1ccc(-c(cc2)ccc2F)o1

InChI : InChI=1S/C18H11Cl2FN2O2/c19-12-3-7-15(16(20)9-12)18(24)23-22-10-14-6-8-17(25-14)11-1-4-13(21)5-2-11/h1-10H,(H,23,24)

InChIK : DNXVVMCZYPZQEI-UHFFFAOYSA-N

TotalMolweight : 377.201

Molweight : 377.201

MonoisotopicMass : 376.01816

CLogP : 5.4533

CLogS : -6.967

H Acceptors : 4

H Donors : 1

TotalSurfaceArea : 273.63

Relative PSA : 0.18317

PolarSurfaceArea : 54.6

Druglikeness : 5.1537

Mutagenic : high

Tumorigenic : high

Reproductive Effective : none

Irritant : none

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

Shape Index : 0.68

Fragments : 1

Non HAtoms : 25

NonCHAtoms : 7

Electronegative Atoms : 7

Rotatable Bond : 4

Rings Closures : 3

Small Rings : 3

Aromatic Rings : 3

Aromatic Atoms : 17

Symmetricatoms : 2

StereoCon :

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1 - 2,4-dichloro-N-[(Z)-[5-(4-fluorophenyl)furan-2-yl]methylideneamino]benzamide
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