KWD2085

[3-[2-(tert-butylamino)-1-hydroxyethyl]-5-(2,2-dimethylpropanoyloxy)phenyl] 2,2-dimethylpropanoate;hydrobromide

Also Known As: KWD2085|1,3-Benzenediol, 5-(2-(t-butylamino)-1-hydroxyethyl)-, neopentanoate, hydrochloride|Propanoic acid, 2,2-dimethyl-, 5-(2-((1,1-dimethylethyl)amino)-1-hydroxyethyl)-1,3-phenylene ester, hydrobromide|[3-[2-(tert-butylamino)-1-hydroxyethyl]-5-(2,2-dimethylpropanoyloxy)phenyl] 2,2-dimethylpropanoate hydrobromide|5-[2-(tert-Butylamino)-1-hydroxyethyl]-1,3-phenylene bis(2,2-dimethylpropanoate)--hydrogen bromide (1/1)

Molecular Formula	C22H36BrNO5
Molecular Weight	473.1777 g/mol
LogP	4.589
Topological Polar Surface Area	84.86 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	473.1777
Monoisotopic Mass	473.1777
Heavy Atoms	29
Complexity	665.13354

Chemical Identifiers

CAS Number	52223-87-7
SMILES	CC(C)(C)C(=O)OC1=CC(=CC(=C1)C(CNC(C)(C)C)O)OC(=O)C(C)(C)C.Br