3-chloro-N-[2-[(2Z)-2-[(3-chloro-4-nitrophenyl)methylidene]hydrazinyl]-2-oxoethyl]benzamide

Formula:C16H12N4O4Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 3-chloro-N-[2-[(2Z)-2-[(3-chloro-4-nitrophenyl)methylidene]hydrazinyl]-2-oxoethyl]benzamide is a drug-like molecule.

MolName	3-chloro-N-[2-[(2Z)-2-[(3-chloro-4-nitrophenyl)methylidene]hydrazinyl]-2-oxoethyl]benzamide
MolecularFormula	C16H12N4O4Cl2
Smiles	[O-][N+](c(ccc(/C=N\NC(CNC(c1cc(Cl)ccc1)=O)=O)c1)c1Cl)=O
InChI	InChI=1S/C16H12Cl2N4O4/c17-12-3-1-2-11(7-12)16(24)19-9-15(23)21-20-8-10-4-5-14(22(25)26)13(18)6-10/h1-8H,9H2,(H,19,24)(H,21,23)
InChIK	QCNYNDSCIGJTHD-UHFFFAOYSA-N
TotalMolweight	395.201
Molweight	395.201
MonoisotopicMass	394.02356
CLogP	2.5757
CLogS	-5.42
H Acceptors	8
H Donors	2
TotalSurfaceArea	284.47
Relative PSA	0.31965
PolarSurfaceArea	116.38
Druglikeness	0.24684
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.65385
Fragments	1
Non HAtoms	26
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Amides	1
AcidicOxygens	1
StereoCon

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