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Merck
CN

P0740

N-(2-Phenylethyl)indomethacinamide

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About This Item

Empirical Formula (Hill Notation):
C27H25N2O3Cl
CAS Number:
Molecular Weight:
460.95
NACRES:
NA.77
PubChem Substance ID:
UNSPSC Code:
12352200
MDL number:
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assay

≥98% (TLC)

Quality Segment

form

solid

mp

158-162 °C

shipped in

wet ice

storage temp.

−20°C

SMILES string

COc1ccc2n(c(C)c(CC(=O)NCCc3ccccc3)c2c1)C(=O)c4ccc(Cl)cc4

InChI

1S/C27H25ClN2O3/c1-18-23(17-26(31)29-15-14-19-6-4-3-5-7-19)24-16-22(33-2)12-13-25(24)30(18)27(32)20-8-10-21(28)11-9-20/h3-13,16H,14-15,17H2,1-2H3,(H,29,31)

InChI key

VYDBTNADENXYSN-UHFFFAOYSA-N

Biochem/physiol Actions

Inhibits human recombinant and ovine cyclooxygenase-2 (COX-2) with IC50s of 0.06 μM and 0.125 μM, respectively; over 400-fold less potent as an inhibitor of COX-1.


Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)



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