N-[(Z)-[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylideneamino]-2-hydroxy-2,2-diphenylacetamide

Formula:C25H18N3O5Cl Mutagenic:high Tumorigenic:high Reproductive Effective:low N-[(Z)-[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylideneamino]-2-hydroxy-2,2-diphenylacetamide is a drug-like molecule.

MolNameN-[(Z)-[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylideneamino]-2-hydroxy-2,2-diphenylacetamide
MolecularFormulaC25H18N3O5Cl
Smiles[O-][N+](c(cc1)cc(-c2ccc(/C=N\NC(C(c3ccccc3)(c3ccccc3)O)=O)o2)c1Cl)=O
InChIInChI=1S/C25H18ClN3O5/c26-22-13-11-19(29(32)33)15-21(22)23-14-12-20(34-23)16-27-28-24(30)25(31,17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-16,31H,(H,28,30)
InChIKCEKAACAAWUNXLD-UHFFFAOYSA-N
TotalMolweight475.887
Molweight475.887
MonoisotopicMass475.093499
CLogP4.1052
CLogS-7.083
H Acceptors8
H Donors2
TotalSurfaceArea352.05
Relative PSA0.26598
PolarSurfaceArea120.65
Druglikeness2.4076
Mutagenichigh
Tumorigenichigh
Reproductive Effectivelow
Irritantnone
Nasty Functionsaromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.5
Fragments1
Non HAtoms34
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond7
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms23
Sp3Atoms3
Symmetricatoms8
AcidicOxygens1
StereoCon

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