2-chloro-N-[6-[(2Z)-2-[(2-nitrophenyl)methylidene]hydrazinyl]-6-oxohexyl]benzamide

Formula:C20H21N4O4Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-chloro-N-[6-[(2Z)-2-[(2-nitrophenyl)methylidene]hydrazinyl]-6-oxohexyl]benzamide is a drug-like molecule.

MolName	2-chloro-N-[6-[(2Z)-2-[(2-nitrophenyl)methylidene]hydrazinyl]-6-oxohexyl]benzamide
MolecularFormula	C20H21N4O4Cl
Smiles	[O-][N+](c1c(/C=N\NC(CCCCCNC(c(cccc2)c2Cl)=O)=O)cccc1)=O
InChI	InChI=1S/C20H21ClN4O4/c21-17-10-5-4-9-16(17)20(27)22-13-7-1-2-12-19(26)24-23-14-15-8-3-6-11-18(15)25(28)29/h3-6,8-11,14H,1-2,7,12-13H2,(H,22,27)(H,24,26)
InChIK	SLVQELDBKCDLCS-UHFFFAOYSA-N
TotalMolweight	416.864
Molweight	416.864
MonoisotopicMass	416.125133
CLogP	3.7873
CLogS	-5.764
H Acceptors	8
H Donors	2
TotalSurfaceArea	324.09
Relative PSA	0.28057
PolarSurfaceArea	116.38
Druglikeness	-9.4775
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.65517
Fragments	1
Non HAtoms	29
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	10
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Amides	1
AcidicOxygens	1
StereoCon

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