4-[(E)-(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]-N-(2-phenylethyl)benzamide

Formula:C24H20N2O2S Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[(E)-(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]-N-(2-phenylethyl)benzamide is a drug-like molecule.

MolName	4-[(E)-(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]-N-(2-phenylethyl)benzamide
MolecularFormula	C24H20N2O2S
Smiles	O=C(c1ccc(/C=C2/Sc(cccc3)c3NC2=O)cc1)NCCc1ccccc1
InChI	InChI=1S/C24H20N2O2S/c27-23(25-15-14-17-6-2-1-3-7-17)19-12-10-18(11-13-19)16-22-24(28)26-20-8-4-5-9-21(20)29-22/h1-13,16H,14-15H2,(H,25,27)(H,26,28)
InChIK	SNXFYHMFYBLSTG-UHFFFAOYSA-N
TotalMolweight	400.501
Molweight	400.501
MonoisotopicMass	400.124548
CLogP	3.544
CLogS	-5.854
H Acceptors	4
H Donors	2
TotalSurfaceArea	307.42
Relative PSA	0.21628
PolarSurfaceArea	83.5
Druglikeness	3.2401
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.65517
Fragments	1
Non HAtoms	29
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	4
Amides	2
StereoCon

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