[4-[(Z)-[[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]hydrazinylidene]methyl]phenyl] 3,4-dichlorobenzoate

Formula:C23H13N3O2Cl4S Mutagenic:none Tumorigenic:high Reproductive Effective:none [4-[(Z)-[[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]hydrazinylidene]methyl]phenyl] 3,4-dichlorobenzoate is not a drug-like molecule.

MolName[4-[(Z)-[[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]hydrazinylidene]methyl]phenyl] 3,4-dichlorobenzoate
MolecularFormulaC23H13N3O2Cl4S
SmilesO=C(c(cc1)cc(Cl)c1Cl)Oc1ccc(/C=N\Nc2nc(-c(ccc(Cl)c3)c3Cl)cs2)cc1
InChIInChI=1S/C23H13Cl4N3O2S/c24-15-4-7-17(19(26)10-15)21-12-33-23(29-21)30-28-11-13-1-5-16(6-2-13)32-22(31)14-3-8-18(25)20(27)9-14/h1-12H,(H,29,30)
InChIKLMJILTLFAXYDDC-UHFFFAOYSA-N
TotalMolweight537.253
Molweight537.253
MonoisotopicMass534.948255
CLogP10.071
CLogS-9.074
H Acceptors5
H Donors1
TotalSurfaceArea372.89
Relative PSA0.20741
PolarSurfaceArea91.82
Druglikeness3.6613
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.66667
Fragments1
Non HAtoms33
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond7
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms23
Sp3Atoms1
Symmetricatoms2
Aromatic Nitrogens1
BasicNitrogens1
StereoCon

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