4-[5-[(Z)-(2-benzyl-6-oxo-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-ylidene)methyl]furan-2-yl]benzenesulfonamide

Formula:C22H16N4O4S2 Mutagenic:high Tumorigenic:high Reproductive Effective:none 4-[5-[(Z)-(2-benzyl-6-oxo-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-ylidene)methyl]furan-2-yl]benzenesulfonamide is a drug-like molecule.

MolName	4-[5-[(Z)-(2-benzyl-6-oxo-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-ylidene)methyl]furan-2-yl]benzenesulfonamide
MolecularFormula	C22H16N4O4S2
Smiles	NS(c(cc1)ccc1-c1ccc(/C=C2\Sc3nc(Cc4ccccc4)nn3C2=O)o1)(=O)=O
InChI	InChI=1S/C22H16N4O4S2/c23-32(28,29)17-9-6-15(7-10-17)18-11-8-16(30-18)13-19-21(27)26-22(31-19)24-20(25-26)12-14-4-2-1-3-5-14/h1-11,13H,12H2,(H2,23,28,29)
InChIK	SSSPGZVARDGPHM-UHFFFAOYSA-N
TotalMolweight	464.525
Molweight	464.525
MonoisotopicMass	464.061296
CLogP	3.1207
CLogS	-5.759
H Acceptors	8
H Donors	1
TotalSurfaceArea	326.26
Relative PSA	0.35953
PolarSurfaceArea	154.76
Druglikeness	7.1585
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.625
Fragments	1
Non HAtoms	32
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	3
Symmetricatoms	5
Amides	1
Aromatic Nitrogens	3
StereoCon

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1 - 4-[5-[(Z)-(2-benzyl-6-oxo-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-ylidene)methyl]furan-2-yl]benzenesulfonamide | 2 - 4-[5-[(Z)-(2-benzyl-6-oxo-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-ylidene)methyl]furan-2-yl]benzenesulfonamide

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