N-[(Z)-(4-chloro-3-nitrophenyl)methylideneamino]-2-[[2-(4-chlorophenoxy)acetyl]amino]acetamide

Formula:C17H14N4O5Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:high N-[(Z)-(4-chloro-3-nitrophenyl)methylideneamino]-2-[[2-(4-chlorophenoxy)acetyl]amino]acetamide is a drug-like molecule.

MolNameN-[(Z)-(4-chloro-3-nitrophenyl)methylideneamino]-2-[[2-(4-chlorophenoxy)acetyl]amino]acetamide
MolecularFormulaC17H14N4O5Cl2
Smiles[O-][N+](c(cc(/C=N\NC(CNC(COc(cc1)ccc1Cl)=O)=O)cc1)c1Cl)=O
InChIInChI=1S/C17H14Cl2N4O5/c18-12-2-4-13(5-3-12)28-10-17(25)20-9-16(24)22-21-8-11-1-6-14(19)15(7-11)23(26)27/h1-8H,9-10H2,(H,20,25)(H,22,24)
InChIKAWWWLDMDMIYPKM-UHFFFAOYSA-N
TotalMolweight425.227
Molweight425.227
MonoisotopicMass424.034125
CLogP2.1506
CLogS-5.2
H Acceptors9
H Donors2
TotalSurfaceArea308.23
Relative PSA0.32745
PolarSurfaceArea125.61
Druglikeness0.17471
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functionsaromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.67857
Fragments1
Non HAtoms28
NonCHAtoms11
Electronegative Atoms11
Rotatable Bond8
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms4
Symmetricatoms2
Amides1
AcidicOxygens1
StereoCon

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