N-[(Z)-(4-chlorophenyl)methylideneamino]-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide

Formula:C17H14N3O3Cl3 Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(Z)-(4-chlorophenyl)methylideneamino]-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide is a drug-like molecule.

MolNameN-[(Z)-(4-chlorophenyl)methylideneamino]-2-[[2-(2,4-dichlorophenoxy)acetyl]amino]acetamide
MolecularFormulaC17H14N3O3Cl3
SmilesO=C(CNC(COc(ccc(Cl)c1)c1Cl)=O)N/N=C\c(cc1)ccc1Cl
InChIInChI=1S/C17H14Cl3N3O3/c18-12-3-1-11(2-4-12)8-22-23-16(24)9-21-17(25)10-26-15-6-5-13(19)7-14(15)20/h1-8H,9-10H2,(H,21,25)(H,23,24)
InChIKBZPHTBJTXYDEMF-UHFFFAOYSA-N
TotalMolweight414.675
Molweight414.675
MonoisotopicMass413.010073
CLogP3.6782
CLogS-5.476
H Acceptors6
H Donors2
TotalSurfaceArea299.98
Relative PSA0.23505
PolarSurfaceArea79.79
Druglikeness5.23
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.73077
Fragments1
Non HAtoms26
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond7
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms3
Symmetricatoms2
Amides1
StereoCon

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