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Home > Encyclopedia > 1-(4-Chlorobenzoyl)-5-hydroxy-2-methyl-1H-indole-3-acetic acid

1-(4-Chlorobenzoyl)-5-hydroxy-2-methyl-1H-indole-3-acetic acid

1-(4-Chlorobenzoyl)-5-hydroxy-2-methyl-1H-indole-3-acetic acid structure

1-(4-Chlorobenzoyl)-5-hydroxy-2-methyl-1H-indole-3-acetic acid 

structure
  • CAS No:

    2504-32-7

  • Formula:

    C18H14ClNO4

  • Chemical Name:

    1-(4-Chlorobenzoyl)-5-hydroxy-2-methyl-1H-indole-3-acetic acid

  • Synonyms:

    1H-Indole-3-acetic acid,1-(4-chlorobenzoyl)-5-hydroxy-2-methyl-;Indole-3-acetic acid,1-(p-chlorobenzoyl)-5-hydroxy-2-methyl-;1-(4-Chlorobenzoyl)-5-hydroxy-2-methyl-1H-indole-3-acetic acid;Demethylindomethacin;1-(p-Chlorobenzoyl)-5-hydroxy-2-methylindole-3-acetic acid;Desmethylindomethacin;5-Hydroxyindomethacin;O-Desmethylindomethacin;[1-(4-Chlorobenzoyl)-5-hydroxy-2-methyl-1H-indol-3-yl]acetic acid;2-(1-(4-Chlorobenzoyl)-5-hydroxy-2-methyl-1H-indol-3-yl)acetic acid

Description

Off-White to Tan Solid

1-(4-Chlorobenzoyl)-5-hydroxy-2-methyl-1H-indole-3-acetic acid Basic Attributes

343.763

343.76

K89VS3UAD8

DTXSID60179746

Characteristics

79.5

3.9

1.40±0.1 g/cm3(Predicted)

>205 °C (decomp)

Drug Information

O-Desmethylindomethacin is a known human metabolite of indomethacin.

5-hydroxyindomethacin

1-(4-Chlorobenzoyl)-5-hydroxy-2-methyl-1H-indole-3-acetic acid Use and Manufacturing

The major metabolite of Indomethacin.

Computed Properties

Molecular Weight:343.8
XLogP3:3.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:343.0611356
Monoisotopic Mass:343.0611356
Topological Polar Surface Area:79.5
Heavy Atom Count:24
Complexity:491
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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