N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-3-iodobenzamide

Formula:C19H15N2O3IS Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-3-iodobenzamide is a drug-like molecule.

MolName	N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-3-iodobenzamide
MolecularFormula	C19H15N2O3IS
Smiles	O=C(c1cccc(I)c1)NCCN(C(/C(/S1)=C/c2ccccc2)=O)C1=O
InChI	InChI=1S/C19H15IN2O3S/c20-15-8-4-7-14(12-15)17(23)21-9-10-22-18(24)16(26-19(22)25)11-13-5-2-1-3-6-13/h1-8,11-12H,9-10H2,(H,21,23)
InChIK	ASNUACLHHIBDET-UHFFFAOYSA-N
TotalMolweight	478.305
Molweight	478.305
MonoisotopicMass	477.984811
CLogP	3.1132
CLogS	-5.04
H Acceptors	5
H Donors	1
TotalSurfaceArea	290.53
Relative PSA	0.24651
PolarSurfaceArea	91.78
Druglikeness	6.1297
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.61538
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	2
Amides	2
StereoCon

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