AC1NYK4G structure

AC1NYK4G

(4E)-5-(3-chlorophenyl)-4-[hydroxy-[4-[(3-methylphenyl)methoxy]phenyl]methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione

Also Known As: (4E)-5-(3-chlorophenyl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione|(4E)-5-(3-chlorophenyl)-4-[hydroxy-[4-[(3-methylphenyl)methoxy]phenyl]methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione|5-(3-chlorophenyl)-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-4-(4-((3-methylbenzyl)oxy)benzoyl)-1H-pyrrol-2(5H)-one

CAS: 836629-74-4
Molecular Formula C28H22ClN3O4S
Molecular Weight 531.1019 g/mol
LogP 6.01364
Topological Polar Surface Area 92.62 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 6
Exact Mass 531.1019
Monoisotopic Mass 531.1019
Heavy Atoms 37
Complexity 1530.4415

Chemical Identifiers

CAS Number 836629-74-4
SMILES CC1=CC(=CC=C1)COC2=CC=C(C=C2)/C(=C\3/C(N(C(=O)C3=O)C4=NN=C(S4)C)C5=CC(=CC=C5)Cl)/O

Product Overview

AC1NYK4G (CAS 836629-74-4), with molecular formula C28H22ClN3O4S and molecular weight 531.1019 g/mol. IUPAC: (4E)-5-(3-chlorophenyl)-4-[hydroxy-[4-[(3-methylphenyl)methoxy]phenyl]methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione.

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