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

Formula:C21H20N2O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-3-phenylpropanamide is a drug-like molecule.

MolName	N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-3-phenylpropanamide
MolecularFormula	C21H20N2O3S
Smiles	O=C(CCc1ccccc1)NCCN(C(/C(/S1)=C/c2ccccc2)=O)C1=O
InChI	InChI=1S/C21H20N2O3S/c24-19(12-11-16-7-3-1-4-8-16)22-13-14-23-20(25)18(27-21(23)26)15-17-9-5-2-6-10-17/h1-10,15H,11-14H2,(H,22,24)
InChIK	LIUFSBZQBLDDNQ-UHFFFAOYSA-N
TotalMolweight	380.467
Molweight	380.467
MonoisotopicMass	380.119463
CLogP	3.1286
CLogS	-4.259
H Acceptors	5
H Donors	1
TotalSurfaceArea	291.77
Relative PSA	0.24547
PolarSurfaceArea	91.78
Druglikeness	4.7287
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.66667
Fragments	1
Non HAtoms	27
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	4
Amides	2
StereoCon

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