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Product Overview

Product Code

TRC-D293285

CAS Number

625115-52-8

Product Format

Neat

Molecular Formula

C19 H17 F N8 O2

Molecular Weight

408.39

API Family

Riociguat

Product Categories

TRC, Impurity Reference Materials

Product Type

Impurity, Metabolite

Documentation

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Product Information

Chemical Data

Analyte Name

N-Desmethyl Riociguat

CAS Number

625115-52-8

Molecular Formula

C19 H17 F N8 O2

Molecular Weight

408.39

Accurate Mass

408.1459

SMILES

COC(=O)Nc1c(N)nc(nc1N)c2nn(Cc3ccccc3F)c4ncccc24

InChI

InChI=1S/C19H17FN8O2/c1-30-19(29)24-14-15(21)25-17(26-16(14)22)13-11-6-4-8-23-18(11)28(27-13)9-10-5-2-3-7-12(10)20/h2-8H,9H2,1H3,(H,24,29)(H4,21,22,25,26)

IUPAC

methyl N-[4,6-diamino-2-[1-[(2-fluorophenyl)methyl]pyrazolo[3,4-b]pyridin-3-yl]pyrimidin-5-yl]carbamate

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Riociguat

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