(2Z)-6-benzyl-2-[(4-fluorophenyl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione

Formula:C19H12N3O2FS Mutagenic:none Tumorigenic:none Reproductive Effective:none (2Z)-6-benzyl-2-[(4-fluorophenyl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione is a drug-like molecule.

MolName(2Z)-6-benzyl-2-[(4-fluorophenyl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7-dione
MolecularFormulaC19H12N3O2FS
SmilesO=C(/C(/SC1=N2)=C/c(cc3)ccc3F)N1N=C(Cc1ccccc1)C2=O
InChIInChI=1S/C19H12FN3O2S/c20-14-8-6-13(7-9-14)11-16-18(25)23-19(26-16)21-17(24)15(22-23)10-12-4-2-1-3-5-12/h1-9,11H,10H2
InChIKJCGIOZPTUSTFHI-UHFFFAOYSA-N
TotalMolweight365.387
Molweight365.387
MonoisotopicMass365.063425
CLogP2.8186
CLogS-5.043
H Acceptors5
TotalSurfaceArea260.07
Relative PSA0.2697
PolarSurfaceArea87.4
Druglikeness4.5502
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.61538
Fragments1
Non HAtoms26
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond3
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms4
StereoCon

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