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Home > Encyclopedia > 3-(2-Methoxy-4-{[(2-methylphenyl)sulfonyl]carbamoyl}benzyl)-1-met hyl-N-[(2R)-4,4,4-trifluoro-2-methylbutyl]-1H-indole-5-carboxamid e

3-(2-Methoxy-4-{[(2-methylphenyl)sulfonyl]carbamoyl}benzyl)-1-met hyl-N-[(2R)-4,4,4-trifluoro-2-methylbutyl]-1H-indole-5-carboxamid e

3-(2-Methoxy-4-{[(2-methylphenyl)sulfonyl]carbamoyl}benzyl)-1-met hyl-N-[(2R)-4,4,4-trifluoro-2-methylbutyl]-1H-indole-5-carboxamid e structure

3-(2-Methoxy-4-{[(2-methylphenyl)sulfonyl]carbamoyl}benzyl)-1-met hyl-N-[(2R)-4,4,4-trifluoro-2-methylbutyl]-1H-indole-5-carboxamid e 

structure
  • CAS No:

    136564-68-6

  • Formula:

    C31H32F3N3O5S

  • Chemical Name:

    3-(2-Methoxy-4-{[(2-methylphenyl)sulfonyl]carbamoyl}benzyl)-1-met hyl-N-[(2R)-4,4,4-trifluoro-2-methylbutyl]-1H-indole-5-carboxamid e

  • Synonyms:

    D-4,8-Dimethyl-nonansaeure;

Description

Masilukast is under investigation in clinical trial NCT01740986 (Safety and Efficacy of SA09012 in Asthma).

3-(2-Methoxy-4-{[(2-methylphenyl)sulfonyl]carbamoyl}benzyl)-1-met hyl-N-[(2R)-4,4,4-trifluoro-2-methylbutyl]-1H-indole-5-carboxamid e Basic Attributes

615.66300

615.20147679 g/mol

2QJ3R1H23S

Characteristics

121.86000

7.75350

1.31g/cm3

1.587

Drug Information

4-((5-((2-methyl-4,4,4-trifluorobutyl)carbamoyl)-1-methylindol-3-yl)methyl)-3-methoxy-N-((2-methylphenyl)sulfonyl)benzamide

Computed Properties

Molecular Weight:615.7
XLogP3:6.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:10
Exact Mass:615.20147679
Monoisotopic Mass:615.20147679
Topological Polar Surface Area:115
Heavy Atom Count:43
Complexity:1070
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 3-(2-Methoxy-4-{[(2-methylphenyl)sulfonyl]carbamoyl}benzyl)-1-met hyl-N-[(2R)-4,4,4-trifluoro-2-methylbutyl]-1H-indole-5-carboxamid e

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