ZNYNHEXNJWXNNA-NQTKYQIASA-N

(2S)-3-[3-[2-(1,3-benzodioxol-5-yloxy)ethyl-methylamino]propyl]-2-(3,5-ditert-butyl-4-hydroxyphenyl)-1,3-thiazolidin-4-one;(E)-but-2-enedioic acid

Also Known As: (S)-(-)-2-(3,5-di-tert- butyl-4-hydroxyphenyl)-3-[3-[N-methyl-N-[2-(3,4-methylenedioxyphenoxy)ethyl]amino]propyl]-1,3-thiazolidin-4-one hydrogen fumarate|(S)-(-)-2-(3,5-di-tert-butyl-4-hydroxyphenyl)-3-[3-[N-methyl-N-[2-(3,4-methylenedioxyphenoxy)ethyl]amino]propyl]-1,3-thiazolidin-4-one hydrogen fumarate

Molecular Formula	C34H46N2O9S
Molecular Weight	658.2924 g/mol
LogP	5.4026
Topological Polar Surface Area	146.07 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	9
Rotatable Bonds	11
Exact Mass	658.2924
Monoisotopic Mass	658.2924
Heavy Atoms	46
Complexity	1377.6682

Chemical Identifiers

CAS Number	183181-89-7
SMILES	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)[C@H]2N(C(=O)CS2)CCCN(C)CCOC3=CC4=C(C=C3)OCO4.C(=C/C(=O)O)\C(=O)O