[4-[(Z)-[[2-[(2-iodobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate

Formula:C23H16N3O4Cl2I Mutagenic:none Tumorigenic:none Reproductive Effective:none [4-[(Z)-[[2-[(2-iodobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate is not a drug-like molecule.

MolName[4-[(Z)-[[2-[(2-iodobenzoyl)amino]acetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate
MolecularFormulaC23H16N3O4Cl2I
SmilesO=C(CNC(c(cccc1)c1I)=O)N/N=C\c(cc1)ccc1OC(c(ccc(Cl)c1)c1Cl)=O
InChIInChI=1S/C23H16Cl2IN3O4/c24-15-7-10-17(19(25)11-15)23(32)33-16-8-5-14(6-9-16)12-28-29-21(30)13-27-22(31)18-3-1-2-4-20(18)26/h1-12H,13H2,(H,27,31)(H,29,30)
InChIKKZGSBTIUHACPGD-UHFFFAOYSA-N
TotalMolweight596.203
Molweight596.203
MonoisotopicMass594.956259
CLogP5.3649
CLogS-7.446
H Acceptors7
H Donors2
TotalSurfaceArea374.59
Relative PSA0.22304
PolarSurfaceArea96.86
Druglikeness5.5192
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantlow
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.66667
Fragments1
Non HAtoms33
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond8
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms2
Symmetricatoms2
Amides1
StereoCon

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