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Product Overview

Product Code

TRC-T548700

CAS Number

1222998-36-8

Product Format

Neat

Molecular Formula

C35 H28 F3 N5 O2

Molecular Weight

607.62

Product Categories

TRC, Enzyme inhibitors, Enzyme inhibitors, Bioactive small molecules, Additional Cancer Bioactive Molecules, Additional Neuro Products

Product Type

Bioactive Small Molecule

Documentation

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Product Information

Chemical Data

Analyte Name

Torin 1

CAS Number

1222998-36-8

Molecular Formula

C35 H28 F3 N5 O2

Molecular Weight

607.62

Accurate Mass

607.2195

SMILES

CCC(=O)N1CCN(CC1)c2ccc(cc2C(F)(F)F)N3C(=O)C=Cc4cnc5ccc(cc5c34)c6cnc7ccccc7c6

InChI

InChI=1S/C35H28F3N5O2/c1-2-32(44)42-15-13-41(14-16-42)31-11-9-26(19-28(31)35(36,37)38)43-33(45)12-8-24-20-40-30-10-7-22(18-27(30)34(24)43)25-17-23-5-3-4-6-29(23)39-21-25/h3-12,17-21H,2,13-16H2,1H3

IUPAC

1-[4-(4-propanoylpiperazin-1-yl)-3-(trifluoromethyl)phenyl]-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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