2-[(5Z)-5-[(3-bromo-4-hydroxy-5-iodophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetic acid

Formula:C12H7NO5BrIS Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(5Z)-5-[(3-bromo-4-hydroxy-5-iodophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetic acid is a drug-like molecule.

MolName	2-[(5Z)-5-[(3-bromo-4-hydroxy-5-iodophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetic acid
MolecularFormula	C12H7NO5BrIS
Smiles	OC(CN(C(/C(/S1)=C/c(cc2Br)cc(I)c2O)=O)C1=O)=O
InChI	InChI=1S/C12H7BrINO5S/c13-6-1-5(2-7(14)10(6)18)3-8-11(19)15(4-9(16)17)12(20)21-8/h1-3,18H,4H2,(H,16,17)
InChIK	ZGXPTBGSRMFJLD-UHFFFAOYSA-N
TotalMolweight	484.06
Molweight	484.06
MonoisotopicMass	482.827303
CLogP	1.6889
CLogS	-4.116
H Acceptors	6
H Donors	2
TotalSurfaceArea	236.88
Relative PSA	0.36457
PolarSurfaceArea	120.21
Druglikeness	-2.7213
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.57143
Fragments	1
Non HAtoms	21
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	3
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	4
Amides	1
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - 2-[(5Z)-5-[(3-bromo-4-hydroxy-5-iodophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetic acid | 2 - 2-[(5Z)-5-[(3-bromo-4-hydroxy-5-iodophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetic acid

Request More Details | 2-[(5Z)-5-[(3-bromo-4-hydroxy-5-iodophenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetic acid

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments