2-hydroxy-N-[(Z)-[3-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]-2,2-diphenylacetamide

Formula:C28H23N3O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-hydroxy-N-[(Z)-[3-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]-2,2-diphenylacetamide is a drug-like molecule.

MolName2-hydroxy-N-[(Z)-[3-[(4-nitrophenyl)methoxy]phenyl]methylideneamino]-2,2-diphenylacetamide
MolecularFormulaC28H23N3O5
Smiles[O-][N+](c1ccc(COc2cc(/C=N\NC(C(c3ccccc3)(c3ccccc3)O)=O)ccc2)cc1)=O
InChIInChI=1S/C28H23N3O5/c32-27(28(33,23-9-3-1-4-10-23)24-11-5-2-6-12-24)30-29-19-22-8-7-13-26(18-22)36-20-21-14-16-25(17-15-21)31(34)35/h1-19,33H,20H2,(H,30,32)
InChIKRGWBNNNQCWPMMZ-UHFFFAOYSA-N
TotalMolweight481.507
Molweight481.507
MonoisotopicMass481.163772
CLogP3.9084
CLogS-6.228
H Acceptors8
H Donors2
TotalSurfaceArea370.7
Relative PSA0.24152
PolarSurfaceArea116.74
Druglikeness0.056667
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsaromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.55556
Fragments1
Non HAtoms36
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond9
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms5
Symmetricatoms10
AcidicOxygens1
StereoCon

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