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

Formula:C22H17N3O5Cl2S Mutagenic:none Tumorigenic:none Reproductive Effective:none [4-[(Z)-[[2-[(4-chlorophenyl)sulfonylamino]acetyl]hydrazinylidene]methyl]phenyl] 2-chlorobenzoate is not a drug-like molecule.

MolName[4-[(Z)-[[2-[(4-chlorophenyl)sulfonylamino]acetyl]hydrazinylidene]methyl]phenyl] 2-chlorobenzoate
MolecularFormulaC22H17N3O5Cl2S
SmilesO=C(CNS(c(cc1)ccc1Cl)(=O)=O)N/N=C\c(cc1)ccc1OC(c(cccc1)c1Cl)=O
InChIInChI=1S/C22H17Cl2N3O5S/c23-16-7-11-18(12-8-16)33(30,31)26-14-21(28)27-25-13-15-5-9-17(10-6-15)32-22(29)19-3-1-2-4-20(19)24/h1-13,26H,14H2,(H,27,28)
InChIKZOWMUYTYIHOALY-UHFFFAOYSA-N
TotalMolweight506.365
Molweight506.365
MonoisotopicMass505.026596
CLogP4.6144
CLogS-5.978
H Acceptors8
H Donors2
TotalSurfaceArea359.14
Relative PSA0.27591
PolarSurfaceArea122.31
Druglikeness7.24
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.66667
Fragments1
Non HAtoms33
NonCHAtoms11
Electronegative Atoms11
Rotatable Bond8
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms3
Symmetricatoms5
Amides1
StereoCon

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