(2Z)-2-benzylidene-3-oxo-N-(2-phenylethyl)-4H-1,4-benzothiazine-6-carboxamide

Formula:C24H20N2O2S Mutagenic:none Tumorigenic:none Reproductive Effective:none (2Z)-2-benzylidene-3-oxo-N-(2-phenylethyl)-4H-1,4-benzothiazine-6-carboxamide is a drug-like molecule.

MolName(2Z)-2-benzylidene-3-oxo-N-(2-phenylethyl)-4H-1,4-benzothiazine-6-carboxamide
MolecularFormulaC24H20N2O2S
SmilesO=C(c(cc1)cc(NC2=O)c1S/C2=C\c1ccccc1)NCCc1ccccc1
InChIInChI=1S/C24H20N2O2S/c27-23(25-14-13-17-7-3-1-4-8-17)19-11-12-21-20(16-19)26-24(28)22(29-21)15-18-9-5-2-6-10-18/h1-12,15-16H,13-14H2,(H,25,27)(H,26,28)
InChIKWJPLRQGNOAFPMI-UHFFFAOYSA-N
TotalMolweight400.501
Molweight400.501
MonoisotopicMass400.124548
CLogP3.544
CLogS-5.854
H Acceptors4
H Donors2
TotalSurfaceArea307.42
Relative PSA0.21628
PolarSurfaceArea83.5
Druglikeness3.2401
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.65517
Fragments1
Non HAtoms29
NonCHAtoms5
Electronegative Atoms5
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms3
Symmetricatoms4
Amides2
StereoCon

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