[4-[(Z)-[(2,2-diphenoxyacetyl)hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate

Formula:C28H20N2O5Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [4-[(Z)-[(2,2-diphenoxyacetyl)hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate is not a drug-like molecule.

MolName[4-[(Z)-[(2,2-diphenoxyacetyl)hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate
MolecularFormulaC28H20N2O5Cl2
SmilesO=C(C(Oc1ccccc1)Oc1ccccc1)N/N=C\c(cc1)ccc1OC(c(ccc(Cl)c1)c1Cl)=O
InChIInChI=1S/C28H20Cl2N2O5/c29-20-13-16-24(25(30)17-20)27(34)35-23-14-11-19(12-15-23)18-31-32-26(33)28(36-21-7-3-1-4-8-21)37-22-9-5-2-6-10-22/h1-18,28H,(H,32,33)
InChIKDJCGRPOOXDPPAG-UHFFFAOYSA-N
TotalMolweight535.382
Molweight535.382
MonoisotopicMass534.074927
CLogP6.6567
CLogS-7.714
H Acceptors7
H Donors1
TotalSurfaceArea397.6
Relative PSA0.19882
PolarSurfaceArea86.22
Druglikeness4.2953
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantlow
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.56757
Fragments1
Non HAtoms37
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond10
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms4
Symmetricatoms11
StereoCon

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