N-[(Z)-[4-(2-chloroanilino)-4-oxobutan-2-ylidene]amino]-2-methoxybenzamide

Formula:C18H18N3O3Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-[4-(2-chloroanilino)-4-oxobutan-2-ylidene]amino]-2-methoxybenzamide is a drug-like molecule.

MolName	N-[(Z)-[4-(2-chloroanilino)-4-oxobutan-2-ylidene]amino]-2-methoxybenzamide
MolecularFormula	C18H18N3O3Cl
Smiles	C/C(/CC(Nc(cccc1)c1Cl)=O)=N/NC(c(cccc1)c1OC)=O
InChI	InChI=1S/C18H18ClN3O3/c1-12(11-17(23)20-15-9-5-4-8-14(15)19)21-22-18(24)13-7-3-6-10-16(13)25-2/h3-10H,11H2,1-2H3,(H,20,23)(H,22,24)
InChIK	QGPXBJADDGJNLO-UHFFFAOYSA-N
TotalMolweight	359.812
Molweight	359.812
MonoisotopicMass	359.103669
CLogP	3.3638
CLogS	-4.685
H Acceptors	6
H Donors	2
TotalSurfaceArea	278.11
Relative PSA	0.25353
PolarSurfaceArea	79.79
Druglikeness	3.8997
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions	acyl-hydrazone
Shape Index	0.6
Fragments	1
Non HAtoms	25
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Amides	1
StereoCon

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1 - N-[(Z)-[4-(2-chloroanilino)-4-oxobutan-2-ylidene]amino]-2-methoxybenzamide | 2 - N-[(Z)-[4-(2-chloroanilino)-4-oxobutan-2-ylidene]amino]-2-methoxybenzamide

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