C28H23BrN2O9S

prop-2-enyl 2-[(3E)-2-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Also Known As: allyl 2-(2-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate|prop-2-en-1-yl 2-{(3E)-2-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate|prop-2-enyl 2-[(3E)-2-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Molecular Formula	C28H23BrN2O9S
Molecular Weight	642.03076 g/mol
LogP	4.66852
Topological Polar Surface Area	144.72 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	11
Rotatable Bonds	7
Exact Mass	642.03076
Monoisotopic Mass	642.03076
Heavy Atoms	41
Complexity	1630.64

Chemical Identifiers

CAS Number	620563-33-9
SMILES	CC1=C(SC(=N1)N2C(/C(=C(/C3=CC4=C(C=C3)OCCO4)\O)/C(=O)C2=O)C5=CC(=C(C(=C5)Br)O)OC)C(=O)OCC=C