N-[(Z)-3-(2-benzoylhydrazinyl)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide

Formula:C23H18N4O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-3-(2-benzoylhydrazinyl)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.

MolNameN-[(Z)-3-(2-benzoylhydrazinyl)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
MolecularFormulaC23H18N4O5
Smiles[O-][N+](c1ccc(/C=C(/C(NNC(c2ccccc2)=O)=O)\NC(c2ccccc2)=O)cc1)=O
InChIInChI=1S/C23H18N4O5/c28-21(17-7-3-1-4-8-17)24-20(15-16-11-13-19(14-12-16)27(31)32)23(30)26-25-22(29)18-9-5-2-6-10-18/h1-15H,(H,24,28)(H,25,29)(H,26,30)
InChIKYDHVOIPKSXGNEA-UHFFFAOYSA-N
TotalMolweight430.419
Molweight430.419
MonoisotopicMass430.127721
CLogP2.3127
CLogS-5.515
H Acceptors9
H Donors3
TotalSurfaceArea328.79
Relative PSA0.31607
PolarSurfaceArea133.12
Druglikeness-0.86239
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsaromatic nitro
Shape Index0.5
Fragments1
Non HAtoms32
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond7
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms1
Symmetricatoms6
Amides1
AcidicOxygens1
StereoCon

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