Products 254750-02-2

CAS 254750-02-2 appears in our catalog under these names: N-[2-(1,1-Dimethylethyl)phenyl]-2-oxoglycyl-N-[(1S)-1-(carboxymethyl)-2-oxo-3-(2,3,5,6-tetrafluorophenoxy)propyl]-L-alaninamide, 98%, 98%, Emricasan, 95%, Emricasan, Emricasan/ 99.11% (existing batch purity), PF 03491390. Offered by: Chemat, Combi-blocks, TRC, TargetMol, Biosynth. Available pack sizes: 10mg, 25mg, 50mg, 100mg, 250mg, 1g, 1mg, 2mg.

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

(3S)-3-[[(2S)-2-[[2-(2-tert-butylanilino)-2-oxoacetyl]amino]propanoyl]amino]-4-oxo-5-(2,3,5,6-tetrafluorophenoxy)pentanoic acid (CAS 254750-02-2) is a chemical compound with the molecular formula C26H27F4N3O7 and a molecular weight of 569.5 g/mol. IUPAC name: (3S)-3-[[(2S)-2-[[2-(2-tert-butylanilino)-2-oxoacetyl]amino]propanoyl]amino]-4-oxo-5-(2,3,5,6-tetrafluorophenoxy)pentanoic acid. InChIKey: SCVHJVCATBPIHN-SJCJKPOMSA-N.

Identity
Molecular formulaC26H27F4N3O7
Molecular weight569.5 g/mol
IUPAC name(3S)-3-[[(2S)-2-[[2-(2-tert-butylanilino)-2-oxoacetyl]amino]propanoyl]amino]-4-oxo-5-(2,3,5,6-tetrafluorophenoxy)pentanoic acid
InChIKeySCVHJVCATBPIHN-SJCJKPOMSA-N
SMILESC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)COC1=C(C(=CC(=C1F)F)F)F)NC(=O)C(=O)NC2=CC=CC=C2C(C)(C)C

Computed by PubChem (NCBI)