Products 958025-66-6

CAS 958025-66-6 appears in our catalog under these names: MPC-3100, MPC–3100, MPC-3100, 98.4%. Offered by: Chemat Brand, TRC, GLPBio, TargetMol, MedChemExpress. Available pack sizes: on request, 500mg, 1mg, 10mg, 25mg, 5mg, 1 mg.

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

(2S)-1-[4-[2-[6-amino-8-[(6-bromo-1,3-benzodioxol-5-yl)sulfanyl]purin-9-yl]ethyl]piperidin-1-yl]-2-hydroxypropan-1-one (CAS 958025-66-6) is a chemical compound with the molecular formula C22H25BrN6O4S and a molecular weight of 549.4 g/mol. IUPAC name: (2S)-1-[4-[2-[6-amino-8-[(6-bromo-1,3-benzodioxol-5-yl)sulfanyl]purin-9-yl]ethyl]piperidin-1-yl]-2-hydroxypropan-1-one. InChIKey: CVBWTNHDKVVFMI-LBPRGKRZSA-N.

Identity
Molecular formulaC22H25BrN6O4S
Molecular weight549.4 g/mol
IUPAC name(2S)-1-[4-[2-[6-amino-8-[(6-bromo-1,3-benzodioxol-5-yl)sulfanyl]purin-9-yl]ethyl]piperidin-1-yl]-2-hydroxypropan-1-one
InChIKeyCVBWTNHDKVVFMI-LBPRGKRZSA-N
SMILESC[C@@H](C(=O)N1CCC(CC1)CCN2C3=NC=NC(=C3N=C2SC4=C(C=C5C(=C4)OCO5)Br)N)O

Computed by PubChem (NCBI)