2-(4-amino-5-oxo-3-phenyl-1,2,4-triazol-1-yl)-N-[(Z)-benzylideneamino]acetamide

Formula:C17H16N6O2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(4-amino-5-oxo-3-phenyl-1,2,4-triazol-1-yl)-N-[(Z)-benzylideneamino]acetamide is a drug-like molecule.

MolName	2-(4-amino-5-oxo-3-phenyl-1,2,4-triazol-1-yl)-N-[(Z)-benzylideneamino]acetamide
MolecularFormula	C17H16N6O2
Smiles	NN(C(c1ccccc1)=NN1CC(N/N=C\c2ccccc2)=O)C1=O
InChI	InChI=1S/C17H16N6O2/c18-23-16(14-9-5-2-6-10-14)21-22(17(23)25)12-15(24)20-19-11-13-7-3-1-4-8-13/h1-11H,12,18H2,(H,20,24)
InChIK	PEKZUHGRTWKXRK-UHFFFAOYSA-N
TotalMolweight	336.354
Molweight	336.354
MonoisotopicMass	336.133474
CLogP	0.9203
CLogS	-3.99
H Acceptors	8
H Donors	2
TotalSurfaceArea	257.09
Relative PSA	0.32257
PolarSurfaceArea	103.39
Druglikeness	4.7587
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.64
Fragments	1
Non HAtoms	25
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	4
StereoCon

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