2-[(2E)-2-(4-bromophenyl)sulfonylimino-3-cyclohexyl-4-oxo-1,3-thiazolidin-5-yl]-N-(4-chlorophenyl)acetamide

Formula:C23H23N3O4BrClS2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(2E)-2-(4-bromophenyl)sulfonylimino-3-cyclohexyl-4-oxo-1,3-thiazolidin-5-yl]-N-(4-chlorophenyl)acetamide is not a drug-like molecule.

MolName	2-[(2E)-2-(4-bromophenyl)sulfonylimino-3-cyclohexyl-4-oxo-1,3-thiazolidin-5-yl]-N-(4-chlorophenyl)acetamide
MolecularFormula	C23H23N3O4BrClS2
Smiles	O=C(CC(C(N1C2CCCCC2)=O)S/C1=N/S(c(cc1)ccc1Br)(=O)=O)Nc(cc1)ccc1Cl
InChI	InChI=1S/C23H23BrClN3O4S2/c24-15-6-12-19(13-7-15)34(31,32)27-23-28(18-4-2-1-3-5-18)22(30)20(33-23)14-21(29)26-17-10-8-16(25)9-11-17/h6-13,18,20H,1-5,14H2,(H,26,29)/t20-/m1/s1
InChIK	IKKBOEREGXNTQH-HXUWFJFHSA-N
TotalMolweight	584.942
Molweight	584.942
MonoisotopicMass	583.000185
CLogP	5.231
CLogS	-6.633
H Acceptors	7
H Donors	1
TotalSurfaceArea	373.93
Relative PSA	0.26387
PolarSurfaceArea	129.59
Druglikeness	-0.17509
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.52941
Fragments	1
Non HAtoms	34
NonCHAtoms	11
Electronegative Atoms	11
StereoCenters	1
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	10
Symmetricatoms	7
Amides	2
StereoCon	racemate

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1 - 2-[(2E)-2-(4-bromophenyl)sulfonylimino-3-cyclohexyl-4-oxo-1,3-thiazolidin-5-yl]-N-(4-chlorophenyl)acetamide | 2 - 2-[(2E)-2-(4-bromophenyl)sulfonylimino-3-cyclohexyl-4-oxo-1,3-thiazolidin-5-yl]-N-(4-chlorophenyl)acetamide

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