2-[[(5Z)-5-benzylidene-4-oxo-1,3-thiazol-2-yl]sulfanyl]-N-(3-fluorophenyl)acetamide

Formula:C18H13N2O2FS2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[[(5Z)-5-benzylidene-4-oxo-1,3-thiazol-2-yl]sulfanyl]-N-(3-fluorophenyl)acetamide is a drug-like molecule.

MolName2-[[(5Z)-5-benzylidene-4-oxo-1,3-thiazol-2-yl]sulfanyl]-N-(3-fluorophenyl)acetamide
MolecularFormulaC18H13N2O2FS2
SmilesO=C(CSC(S/C1=C\c2ccccc2)=NC1=O)Nc1cc(F)ccc1
InChIInChI=1S/C18H13FN2O2S2/c19-13-7-4-8-14(10-13)20-16(22)11-24-18-21-17(23)15(25-18)9-12-5-2-1-3-6-12/h1-10H,11H2,(H,20,22)
InChIKLVSSEURGCMGHLL-UHFFFAOYSA-N
TotalMolweight372.443
Molweight372.443
MonoisotopicMass372.040246
CLogP4.0423
CLogS-5.338
H Acceptors4
H Donors1
TotalSurfaceArea269.25
Relative PSA0.31209
PolarSurfaceArea109.13
Druglikeness1.6388
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.64
Fragments1
Non HAtoms25
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond5
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms3
Symmetricatoms2
Amides1
StereoCon

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