[4-[(Z)-[[2,2-bis(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate

Formula:C28H18N2O5Cl4 Mutagenic:none Tumorigenic:none Reproductive Effective:high [4-[(Z)-[[2,2-bis(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate is not a drug-like molecule.

MolName[4-[(Z)-[[2,2-bis(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate
MolecularFormulaC28H18N2O5Cl4
SmilesO=C(C(Oc(cc1)ccc1Cl)Oc(cc1)ccc1Cl)N/N=C\c(cc1)ccc1OC(c(ccc(Cl)c1)c1Cl)=O
InChIInChI=1S/C28H18Cl4N2O5/c29-18-3-10-22(11-4-18)38-28(39-23-12-5-19(30)6-13-23)26(35)34-33-16-17-1-8-21(9-2-17)37-27(36)24-14-7-20(31)15-25(24)32/h1-16,28H,(H,34,35)
InChIKGEJCXHLCPIECIW-UHFFFAOYSA-N
TotalMolweight604.272
Molweight604.272
MonoisotopicMass601.996981
CLogP7.8687
CLogS-9.186
H Acceptors7
H Donors1
TotalSurfaceArea428.44
Relative PSA0.18451
PolarSurfaceArea86.22
Druglikeness4.2953
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantlow
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.5641
Fragments1
Non HAtoms39
NonCHAtoms11
Electronegative Atoms11
Rotatable Bond10
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms4
Symmetricatoms12
StereoCon

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