N'-[4-[(5E)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoyl]benzohydrazide

Formula:C21H18N3O3ClS2 Mutagenic:none Tumorigenic:high Reproductive Effective:none N'-[4-[(5E)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoyl]benzohydrazide is a drug-like molecule.

MolName	N'-[4-[(5E)-5-[(2-chlorophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoyl]benzohydrazide
MolecularFormula	C21H18N3O3ClS2
Smiles	O=C(CCCN(C(/C(/S1)=C\c(cccc2)c2Cl)=O)C1=S)NNC(c1ccccc1)=O
InChI	InChI=1S/C21H18ClN3O3S2/c22-16-10-5-4-9-15(16)13-17-20(28)25(21(29)30-17)12-6-11-18(26)23-24-19(27)14-7-2-1-3-8-14/h1-5,7-10,13H,6,11-12H2,(H,23,26)(H,24,27)
InChIK	VCGAKNVBSYIHOV-UHFFFAOYSA-N
TotalMolweight	459.977
Molweight	459.977
MonoisotopicMass	459.047809
CLogP	2.5148
CLogS	-5.87
H Acceptors	6
H Donors	2
TotalSurfaceArea	337.6
Relative PSA	0.32903
PolarSurfaceArea	135.9
Druglikeness	4.4749
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.63333
Fragments	1
Non HAtoms	30
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	2
Amides	1
StereoCon

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