N'-[2-[(5Z)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetyl]-2-hydroxybenzohydrazide

Formula:C19H15N3O4S2 Mutagenic:high Tumorigenic:high Reproductive Effective:low N'-[2-[(5Z)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetyl]-2-hydroxybenzohydrazide is a drug-like molecule.

MolNameN'-[2-[(5Z)-5-benzylidene-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetyl]-2-hydroxybenzohydrazide
MolecularFormulaC19H15N3O4S2
SmilesOc(cccc1)c1C(NNC(CN(C(/C(/S1)=C/c2ccccc2)=O)C1=S)=O)=O
InChIInChI=1S/C19H15N3O4S2/c23-14-9-5-4-8-13(14)17(25)21-20-16(24)11-22-18(26)15(28-19(22)27)10-12-6-2-1-3-7-12/h1-10,23H,11H2,(H,20,24)(H,21,25)
InChIKOROGCLWOUZBUQB-UHFFFAOYSA-N
TotalMolweight413.477
Molweight413.477
MonoisotopicMass413.050397
CLogP0.6543
CLogS-4.298
H Acceptors7
H Donors3
TotalSurfaceArea301.01
Relative PSA0.41254
PolarSurfaceArea156.13
Druglikeness5.2618
Mutagenichigh
Tumorigenichigh
Reproductive Effectivelow
Irritantnone
Nasty Functions
Shape Index0.60714
Fragments1
Non HAtoms28
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond5
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms4
Symmetricatoms2
Amides1
StereoCon

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