Products 1799974-69-8

CAS 1799974-69-8 appears in our catalog under these names: KI696 isomer/ 99.8% (existing batch purity), KI696 isomer 99%, (R)-3-(7-Methoxy-1-methyl-1H-benzo[d][1,2,3]triazol-5-yl)-3-(4-methyl-3-(((R)-4-methyl-1,1-dioxido-3,4-dihydro-2H-benzo[b][1,4,5]oxathiazepin-2-yl)methyl)phenyl)propanoic acid, 99%, 99%, KI696 isomer, 99.32%, KI696 isomer (Standard). Offered by: TargetMol, Ambeed, Chemat, MedChemExpress. Available pack sizes: 1mg, 5mg, 10mg, 25mg, 50mg, 100mg, 250mg, 10mM/1mL.

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

(3R)-3-(7-methoxy-1-methylbenzotriazol-5-yl)-3-[4-methyl-3-[[(4R)-4-methyl-1,1-dioxo-3,4-dihydro-5,1lambda6,2-benzoxathiazepin-2-yl]methyl]phenyl]propanoic acid (CAS 1799974-69-8) is a chemical compound with the molecular formula C28H30N4O6S and a molecular weight of 550.6 g/mol. IUPAC name: (3R)-3-(7-methoxy-1-methylbenzotriazol-5-yl)-3-[4-methyl-3-[[(4R)-4-methyl-1,1-dioxo-3,4-dihydro-5,1lambda6,2-benzoxathiazepin-2-yl]methyl]phenyl]propanoic acid. InChIKey: ZDNGJXBUEQNFBQ-XMSQKQJNSA-N.

Identity
Molecular formulaC28H30N4O6S
Molecular weight550.6 g/mol
IUPAC name(3R)-3-(7-methoxy-1-methylbenzotriazol-5-yl)-3-[4-methyl-3-[[(4R)-4-methyl-1,1-dioxo-3,4-dihydro-5,1lambda6,2-benzoxathiazepin-2-yl]methyl]phenyl]propanoic acid
InChIKeyZDNGJXBUEQNFBQ-XMSQKQJNSA-N
SMILESC[C@@H]1CN(S(=O)(=O)C2=CC=CC=C2O1)CC3=C(C=CC(=C3)[C@@H](CC(=O)O)C4=CC5=C(C(=C4)OC)N(N=N5)C)C

Computed by PubChem (NCBI)

Synonyms: orb1709337