[4-[(Z)-[[2-(4-phenylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzoate

Formula:C28H21N2O4Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none [4-[(Z)-[[2-(4-phenylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzoate is not a drug-like molecule.

MolName[4-[(Z)-[[2-(4-phenylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzoate
MolecularFormulaC28H21N2O4Cl
SmilesO=C(COc(cc1)ccc1-c1ccccc1)N/N=C\c(cc1)ccc1OC(c(cc1)ccc1Cl)=O
InChIInChI=1S/C28H21ClN2O4/c29-24-12-8-23(9-13-24)28(33)35-26-14-6-20(7-15-26)18-30-31-27(32)19-34-25-16-10-22(11-17-25)21-4-2-1-3-5-21/h1-18H,19H2,(H,31,32)
InChIKJVNMNPXGTKSHJE-UHFFFAOYSA-N
TotalMolweight484.938
Molweight484.938
MonoisotopicMass484.118985
CLogP6.4722
CLogS-7.793
H Acceptors6
H Donors1
TotalSurfaceArea373.44
Relative PSA0.1849
PolarSurfaceArea76.99
Druglikeness4.0206
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.71429
Fragments1
Non HAtoms35
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond9
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms3
Symmetricatoms8
StereoCon

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