2-(2,4-dichlorophenoxy)-N-[(Z)-[5-(3,4-dichlorophenyl)furan-2-yl]methylideneamino]acetamide

Formula:C19H12N2O3Cl4 Mutagenic:high Tumorigenic:high Reproductive Effective:high 2-(2,4-dichlorophenoxy)-N-[(Z)-[5-(3,4-dichlorophenyl)furan-2-yl]methylideneamino]acetamide is not a drug-like molecule.

MolName2-(2,4-dichlorophenoxy)-N-[(Z)-[5-(3,4-dichlorophenyl)furan-2-yl]methylideneamino]acetamide
MolecularFormulaC19H12N2O3Cl4
SmilesO=C(COc(ccc(Cl)c1)c1Cl)N/N=C\c1ccc(-c(cc2)cc(Cl)c2Cl)o1
InChIInChI=1S/C19H12Cl4N2O3/c20-12-2-5-18(16(23)8-12)27-10-19(26)25-24-9-13-3-6-17(28-13)11-1-4-14(21)15(22)7-11/h1-9H,10H2,(H,25,26)
InChIKJPUOHXYUGLBARG-UHFFFAOYSA-N
TotalMolweight458.127
Molweight458.127
MonoisotopicMass455.960201
CLogP6.1394
CLogS-7.905
H Acceptors5
H Donors1
TotalSurfaceArea321.88
Relative PSA0.18678
PolarSurfaceArea63.83
Druglikeness6.4337
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.67857
Fragments1
Non HAtoms28
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond6
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms17
Sp3Atoms2
StereoCon

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