2-[(5E)-2,4-dioxo-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-N-(2-morpholin-4-ylphenyl)acetamide

Formula:C20H19N3O4S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(5E)-2,4-dioxo-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-N-(2-morpholin-4-ylphenyl)acetamide is a drug-like molecule.

MolName2-[(5E)-2,4-dioxo-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-N-(2-morpholin-4-ylphenyl)acetamide
MolecularFormulaC20H19N3O4S2
SmilesO=C(CN(C(/C(/S1)=C\c2cccs2)=O)C1=O)Nc(cccc1)c1N1CCOCC1
InChIInChI=1S/C20H19N3O4S2/c24-18(21-15-5-1-2-6-16(15)22-7-9-27-10-8-22)13-23-19(25)17(29-20(23)26)12-14-4-3-11-28-14/h1-6,11-12H,7-10,13H2,(H,21,24)
InChIKZMVBONIBDHLKOQ-UHFFFAOYSA-N
TotalMolweight429.52
Molweight429.52
MonoisotopicMass429.081697
CLogP2.0703
CLogS-4.174
H Acceptors7
H Donors1
TotalSurfaceArea308.27
Relative PSA0.34233
PolarSurfaceArea132.49
Druglikeness5.018
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionslimit! methylene-thiazolidine-2,4-dione
Shape Index0.55172
Fragments1
Non HAtoms29
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms8
Symmetricatoms2
Amides2
Amines1
Aromatic Amines1
StereoCon

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