RefChem:1056938

(E)-but-2-enedioic acid;bis(1-[3-(hexoxymethyl)-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]propan-1-one)

Also Known As: 1-(Hexyloxymethyl)-4-((2-hydroxy-3-(isopropylamino)propoxy)phenyl)propanone maleate (2:1)|1-Propanone, 1-(3-((hexyloxy)methyl)-4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)-, (E)-2-butenedioate (2:1) (salt)|1-(4-(2-Hydroxy-3-(Isopropylamino)propoxy)-3-(Propoxy Methyl)phenyl)propanonemaleate|(E)-but-2-enedioic acid; 1-[3-(hexoxymethyl)-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]propan-1-one|1-[3-Hexyloxymethyl-4-(2-hydroxy-3-isopropylamino-propoxy)-phenyl]-propan-1-one; compound with (E)-but-2-enedioic acid

Molecular Formula	C48H78N2O12
Molecular Weight	874.5555 g/mol
LogP	7.9396
Topological Polar Surface Area	210.18 Ų
Hydrogen Bond Donors	6
Hydrogen Bond Acceptors	12
Rotatable Bonds	32
Exact Mass	874.5555
Monoisotopic Mass	874.5555
Heavy Atoms	62
Complexity	1448.9905

Chemical Identifiers

CAS Number	106909-59-5
SMILES	CCCCCCOCC1=C(C=CC(=C1)C(=O)CC)OCC(CNC(C)C)O.CCCCCCOCC1=C(C=CC(=C1)C(=O)CC)OCC(CNC(C)C)O.C(=C/C(=O)O)\C(=O)O