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C18H11N2O2Cl3 | Cheminformatics
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2,4-dichloro-N-[(Z)-[5-(4-chlorophenyl)furan-2-yl]methylideneamino]benzamide

Molecular Formula : C18H11N2O2Cl3 | Mutagenic : high | Tumorigenic : high | Reproductive Effective : none |
2,4-dichloro-N-[(Z)-[5-(4-chlorophenyl)furan-2-yl]methylideneamino]benzamide is not a drug-like molecule.

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

MolecularFormula : C18H11N2O2Cl3

Smiles : O=C(c(ccc(Cl)c1)c1Cl)N/N=C\c1ccc(-c(cc2)ccc2Cl)o1

InChI : InChI=1S/C18H11Cl3N2O2/c19-12-3-1-11(2-4-12)17-8-6-14(25-17)10-22-23-18(24)15-7-5-13(20)9-16(15)21/h1-10H,(H,23,24)

InChIK : ULTZOZLFXVINMQ-UHFFFAOYSA-N

TotalMolweight : 393.656

Molweight : 393.656

MonoisotopicMass : 391.988609

CLogP : 5.9585

CLogS : -7.389

H Acceptors : 4

H Donors : 1

TotalSurfaceArea : 282.7

Relative PSA : 0.17729

PolarSurfaceArea : 54.6

Druglikeness : 6.4937

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-chlorophenyl)furan-2-yl]methylideneamino]benzamide
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