RefChem:1049223

(1,4-dimethyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl)methyl 2-cyclobutyl-2-hydroxy-2-phenylacetate chloride

Also Known As: AC1L1PYY|AC1Q1SKX|RefChem:1049223|Mandelic acid, alpha-cyclobutyl-, 1,4-dimethyl-1,2,3,6-tetrahydro-3-pyridylmethyl ester, hydrochloride|(1,4-Dimethyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl)methyl2-cyclobutyl-2-hydroxy-2-phenylacetate chloride|MANDELIC ACID, alpha-CYCLOBUTYL-, 1,4-DIMETHYL-1,2,3,6-TETRAHYDRO-3-PYRIDYLMETHY|(1,4-dimethyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl)methyl 2-cyclobutyl-2-hydroxy-2-phenylacetate chloride|(1,4-dimethyl-1,2,3,6-tetrahydropyridin-1-ium-3-yl)methyl2-cyclobutyl-2-hydroxy-2-phenylacetate|(1,4-Dimethyl-1,2,3,6-tetrahydropyridin-3-yl)methyl cyclobutyl(hydroxy)phenylacetate--hydrogen chloride (1/1)|3-({[cyclobutyl(hydroxy)phenylacetyl]oxy}methyl)-1,4-dimethyl-1,2,3,6-tetrahydropyridinium chloride

Molecular Formula	C20H28ClNO3
Molecular Weight	365.17578 g/mol
LogP	-1.69
Topological Polar Surface Area	50.97 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	5
Exact Mass	365.17578
Heavy Atoms	25
Complexity	614.6

Chemical Identifiers

CAS Number	101756-55-2
SMILES	CC1=CC[NH+](CC1COC(=O)C(C2CCC2)(C3=CC=CC=C3)O)C.[Cl-]