N-benzyl-N'-[(Z)-[4-oxo-4-[3-(trifluoromethyl)anilino]butan-2-ylidene]amino]oxamide

Formula:C20H19N4O3F3 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-benzyl-N'-[(Z)-[4-oxo-4-[3-(trifluoromethyl)anilino]butan-2-ylidene]amino]oxamide is a drug-like molecule.

MolName	N-benzyl-N'-[(Z)-[4-oxo-4-[3-(trifluoromethyl)anilino]butan-2-ylidene]amino]oxamide
MolecularFormula	C20H19N4O3F3
Smiles	C/C(/CC(Nc1cccc(C(F)(F)F)c1)=O)=N/NC(C(NCc1ccccc1)=O)=O
InChI	InChI=1S/C20H19F3N4O3/c1-13(10-17(28)25-16-9-5-8-15(11-16)20(21,22)23)26-27-19(30)18(29)24-12-14-6-3-2-4-7-14/h2-9,11H,10,12H2,1H3,(H,24,29)(H,25,28)(H,27,30)
InChIK	MGHRBDSHPUTNLN-UHFFFAOYSA-N
TotalMolweight	420.39
Molweight	420.39
MonoisotopicMass	420.140925
CLogP	2.3278
CLogS	-4.329
H Acceptors	7
H Donors	3
TotalSurfaceArea	312.86
Relative PSA	0.27172
PolarSurfaceArea	99.66
Druglikeness	-4.0764
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; limit! oxal-diamide
Shape Index	0.63333
Fragments	1
Non HAtoms	30
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	4
Amides	2
StereoCon

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