N-[(E)-(3-benzyl-4-oxo-1,3-thiazolidin-2-ylidene)amino]-2-(4-fluorophenoxy)acetamide

Formula:C18H16N3O3FS Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(E)-(3-benzyl-4-oxo-1,3-thiazolidin-2-ylidene)amino]-2-(4-fluorophenoxy)acetamide is a drug-like molecule.

MolNameN-[(E)-(3-benzyl-4-oxo-1,3-thiazolidin-2-ylidene)amino]-2-(4-fluorophenoxy)acetamide
MolecularFormulaC18H16N3O3FS
SmilesO=C(COc(cc1)ccc1F)N/N=C(\N1Cc2ccccc2)/SCC1=O
InChIInChI=1S/C18H16FN3O3S/c19-14-6-8-15(9-7-14)25-11-16(23)20-21-18-22(17(24)12-26-18)10-13-4-2-1-3-5-13/h1-9H,10-12H2,(H,20,23)
InChIKBTQAYAUMELFMCS-UHFFFAOYSA-N
TotalMolweight373.407
Molweight373.407
MonoisotopicMass373.08964
CLogP2.3314
CLogS-4.155
H Acceptors6
H Donors1
TotalSurfaceArea274.87
Relative PSA0.29137
PolarSurfaceArea96.3
Druglikeness4.1969
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone
Shape Index0.65385
Fragments1
Non HAtoms26
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond6
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms5
Symmetricatoms4
Amides1
StereoCon

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