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

Formula:C20H15N3O3S Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-4-cyanobenzamide is a drug-like molecule.

MolName	N-[2-[(5Z)-5-benzylidene-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-4-cyanobenzamide
MolecularFormula	C20H15N3O3S
Smiles	N#Cc(cc1)ccc1C(NCCN(C(/C(/S1)=C/c2ccccc2)=O)C1=O)=O
InChI	InChI=1S/C20H15N3O3S/c21-13-15-6-8-16(9-7-15)18(24)22-10-11-23-19(25)17(27-20(23)26)12-14-4-2-1-3-5-14/h1-9,12H,10-11H2,(H,22,24)
InChIK	SNXDWQKCSRRJNZ-UHFFFAOYSA-N
TotalMolweight	377.423
Molweight	377.423
MonoisotopicMass	377.083412
CLogP	2.5117
CLogS	-4.797
H Acceptors	6
H Donors	1
TotalSurfaceArea	285.96
Relative PSA	0.29787
PolarSurfaceArea	115.57
Druglikeness	1.4476
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	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	4
Amides	2
StereoCon

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