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Merck
CN

PZ0336

TMI-1

≥98% (HPLC)

Synonym(s):

4-[[4-(2-Butynyloxy)phenyl]sulfonyl]-N-hydroxy-2,2-dimethyl-(3S)thiomorpholinecarboxamide, TMI 1, WAY-171318

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About This Item

Empirical Formula (Hill Notation):
C17H22N2O5S2
CAS Number:
287403-39-8
Molecular Weight:
398.50
UNSPSC Code:
12352200
PubChem Substance ID:
329823847
NACRES:
NA.77

Key Documents

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SMILES string

O=S(N1[C@@H](C(NO)=O)C(C)(C)SCC1)(C2=CC=C(OCC#CC)C=C2)=O

InChI

1S/C17H22N2O5S2/c1-4-5-11-24-13-6-8-14(9-7-13)26(22,23)19-10-12-25-17(2,3)15(19)16(20)18-21/h6-9,15,21H,10-12H2,1-3H3,(H,18,20)/t15-/m0/s1

InChI key

CVZIHNYAZLXRRS-HNNXBMFYSA-N

assay

≥98% (HPLC)

form

powder

color

white to beige

solubility

DMSO: 25 mg/mL, clear

storage temp.

room temp

Quality Level

100

Biochem/physiol Actions

TMI-1 (WAY-171318) is potent inhibitor of disintegrin metalloenzyme 17 (ADAM17) also known as the tumor necrosis factor-α (TNF-α) converting enzyme (TACE), and matrix metalloprotease (MMP). TMI-1 potently inhibits LPS-induced TNF-α secretion in human primary monocytes, and human whole blood. TMI-1 selectively induces caspase-dependent apoptosis in triple negative (TN) and ERBB2-overexpressing breast tumor cell lines.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
0000489047
0000489046
0000489046
0000489047
0000380162

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