6-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-N-(2,4,6-tribromophenyl)hexanamide

Formula:C20H17N2O2Br3S3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 6-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-N-(2,4,6-tribromophenyl)hexanamide is not a drug-like molecule.

MolName	6-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-N-(2,4,6-tribromophenyl)hexanamide
MolecularFormula	C20H17N2O2Br3S3
Smiles	O=C(CCCCCN(C(/C(/S1)=C/c2cccs2)=O)C1=S)Nc(c(Br)cc(Br)c1)c1Br
InChI	InChI=1S/C20H17Br3N2O2S3/c21-12-9-14(22)18(15(23)10-12)24-17(26)6-2-1-3-7-25-19(27)16(30-20(25)28)11-13-5-4-8-29-13/h4-5,8-11H,1-3,6-7H2,(H,24,26)
InChIK	XLASNIALZWPBIH-UHFFFAOYSA-N
TotalMolweight	653.277
Molweight	653.277
MonoisotopicMass	649.800221
CLogP	6.0493
CLogS	-8.004
H Acceptors	4
H Donors	1
TotalSurfaceArea	372.32
Relative PSA	0.28723
PolarSurfaceArea	135.04
Druglikeness	-4.7041
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	polyhalo aromatic ring
Shape Index	0.63333
Fragments	1
Non HAtoms	30
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	7
Symmetricatoms	3
Amides	2
StereoCon

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1 - 6-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-N-(2,4,6-tribromophenyl)hexanamide | 2 - 6-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]-N-(2,4,6-tribromophenyl)hexanamide

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