(2E)-2-[(3-chlorophenyl)methylidene]-3-oxo-N-(thiophen-2-ylmethyl)-4H-1,4-benzothiazine-6-carboxamide

Formula:C21H15N2O2ClS2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (2E)-2-[(3-chlorophenyl)methylidene]-3-oxo-N-(thiophen-2-ylmethyl)-4H-1,4-benzothiazine-6-carboxamide is a drug-like molecule.

MolName	(2E)-2-[(3-chlorophenyl)methylidene]-3-oxo-N-(thiophen-2-ylmethyl)-4H-1,4-benzothiazine-6-carboxamide
MolecularFormula	C21H15N2O2ClS2
Smiles	O=C(c(cc1)cc(NC2=O)c1S/C2=C/c1cccc(Cl)c1)NCc1cccs1
InChI	InChI=1S/C21H15ClN2O2S2/c22-15-4-1-3-13(9-15)10-19-21(26)24-17-11-14(6-7-18(17)28-19)20(25)23-12-16-5-2-8-27-16/h1-11H,12H2,(H,23,25)(H,24,26)
InChIK	ARJNYGJUERAPJV-UHFFFAOYSA-N
TotalMolweight	426.947
Molweight	426.947
MonoisotopicMass	426.026345
CLogP	3.5865
CLogS	-6.488
H Acceptors	4
H Donors	2
TotalSurfaceArea	305.02
Relative PSA	0.28474
PolarSurfaceArea	111.74
Druglikeness	3.7498
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.60714
Fragments	1
Non HAtoms	28
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Amides	2
StereoCon

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