2,4-dichloro-N-[3-methyl-1-oxo-1-[(2Z)-2-(pyridin-3-ylmethylidene)hydrazinyl]butan-2-yl]benzamide

Formula:C18H18N4O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2,4-dichloro-N-[3-methyl-1-oxo-1-[(2Z)-2-(pyridin-3-ylmethylidene)hydrazinyl]butan-2-yl]benzamide is a drug-like molecule.

MolName	2,4-dichloro-N-[3-methyl-1-oxo-1-[(2Z)-2-(pyridin-3-ylmethylidene)hydrazinyl]butan-2-yl]benzamide
MolecularFormula	C18H18N4O2Cl2
Smiles	CC(C)C(C(N/N=C\c1cnccc1)=O)NC(c(ccc(Cl)c1)c1Cl)=O
InChI	InChI=1S/C18H18Cl2N4O2/c1-11(2)16(18(26)24-22-10-12-4-3-7-21-9-12)23-17(25)14-6-5-13(19)8-15(14)20/h3-11,16H,1-2H3,(H,23,25)(H,24,26)/t16-/m0/s1
InChIK	BMROFBDFGKVZBH-INIZCTEOSA-N
TotalMolweight	393.273
Molweight	393.273
MonoisotopicMass	392.08068
CLogP	3.5284
CLogS	-4.973
H Acceptors	6
H Donors	2
TotalSurfaceArea	295.32
Relative PSA	0.24204
PolarSurfaceArea	83.45
Druglikeness	6.5884
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.61538
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
StereoCenters	1
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	1
Amides	1
Aromatic Nitrogens	1
StereoCon	racemate

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1 - 2,4-dichloro-N-[3-methyl-1-oxo-1-[(2Z)-2-(pyridin-3-ylmethylidene)hydrazinyl]butan-2-yl]benzamide | 2 - 2,4-dichloro-N-[3-methyl-1-oxo-1-[(2Z)-2-(pyridin-3-ylmethylidene)hydrazinyl]butan-2-yl]benzamide

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