N-(4-chlorophenyl)-2-[(2E)-4-oxo-3-phenyl-2-thiophen-2-ylsulfonylimino-1,3-thiazolidin-5-yl]acetamide

Formula:C21H16N3O4ClS3 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-(4-chlorophenyl)-2-[(2E)-4-oxo-3-phenyl-2-thiophen-2-ylsulfonylimino-1,3-thiazolidin-5-yl]acetamide is not a drug-like molecule.

MolName	N-(4-chlorophenyl)-2-[(2E)-4-oxo-3-phenyl-2-thiophen-2-ylsulfonylimino-1,3-thiazolidin-5-yl]acetamide
MolecularFormula	C21H16N3O4ClS3
Smiles	O=C(CC(C(N1c2ccccc2)=O)S/C1=N/S(c1cccs1)(=O)=O)Nc(cc1)ccc1Cl
InChI	InChI=1S/C21H16ClN3O4S3/c22-14-8-10-15(11-9-14)23-18(26)13-17-20(27)25(16-5-2-1-3-6-16)21(31-17)24-32(28,29)19-7-4-12-30-19/h1-12,17H,13H2,(H,23,26)/t17-/m0/s1
InChIK	KLWMDEDTXHMIOD-KRWDZBQOSA-N
TotalMolweight	506.026
Molweight	506.026
MonoisotopicMass	504.999144
CLogP	4.4344
CLogS	-5.987
H Acceptors	7
H Donors	1
TotalSurfaceArea	343.2
Relative PSA	0.34682
PolarSurfaceArea	157.83
Druglikeness	7.7771
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	32
NonCHAtoms	11
Electronegative Atoms	11
StereoCenters	1
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	4
Symmetricatoms	5
Amides	2
StereoCon	racemate

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