AC1NXRC2

(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-[5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione

Also Known As: 4-(2,3-dihydrobenzo[b][1,4]dioxine-6-carbonyl)-1-(5-((2-fluorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-3-hydroxy-5-(4-isopropylphenyl)-1H-pyrrol-2(5H)-one|(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-[5-[(2-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-5-(4-propan-2-ylphenyl)pyrrolidine-2,3-dione|(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione

Molecular Formula	C31H26FN3O5S2
Molecular Weight	603.1298 g/mol
LogP	6.4904
Topological Polar Surface Area	101.85 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	9
Rotatable Bonds	7
Exact Mass	603.1298
Monoisotopic Mass	603.1298
Heavy Atoms	42
Complexity	1702.9038

Chemical Identifiers

CAS Number	620577-75-5
SMILES	CC(C)C1=CC=C(C=C1)C2/C(=C(/C3=CC4=C(C=C3)OCCO4)\O)/C(=O)C(=O)N2C5=NN=C(S5)SCC6=CC=CC=C6F