Products 2135743-21-2

CAS 2135743-21-2 is the registry number for β2AR antagonist 1. Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

2-[2-[2-[2-[[(2S)-3-(3-bromophenyl)-2-[[(2S)-3-(4-carbamoylphenyl)-2-[(2-cyclohexyl-2-phenylacetyl)amino]propanoyl]amino]propanoyl]amino]ethoxy]ethoxy]ethoxy]acetic acid (CAS 2135743-21-2) is a chemical compound with the molecular formula C41H51BrN4O9 and a molecular weight of 823.8 g/mol. IUPAC name: 2-[2-[2-[2-[[(2S)-3-(3-bromophenyl)-2-[[(2S)-3-(4-carbamoylphenyl)-2-[(2-cyclohexyl-2-phenylacetyl)amino]propanoyl]amino]propanoyl]amino]ethoxy]ethoxy]ethoxy]acetic acid. InChIKey: LKQBHDWHOYRIRJ-FWBANIIHSA-N.

Identity
Molecular formulaC41H51BrN4O9
Molecular weight823.8 g/mol
IUPAC name2-[2-[2-[2-[[(2S)-3-(3-bromophenyl)-2-[[(2S)-3-(4-carbamoylphenyl)-2-[(2-cyclohexyl-2-phenylacetyl)amino]propanoyl]amino]propanoyl]amino]ethoxy]ethoxy]ethoxy]acetic acid
InChIKeyLKQBHDWHOYRIRJ-FWBANIIHSA-N
SMILESC1CCC(CC1)C(C2=CC=CC=C2)C(=O)N[C@@H](CC3=CC=C(C=C3)C(=O)N)C(=O)N[C@@H](CC4=CC(=CC=C4)Br)C(=O)NCCOCCOCCOCC(=O)O

Computed by PubChem (NCBI)