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Home > Encyclopedia > Benzo[b]thiophene-2-carboxylic acid, 3-chloro-6-fluoro-, 2-[4,5-dihydro-5-(4-methoxyphenyl)-3-phenyl-1H-pyrazol-1-yl]-2-oxoethyl ester (9CI)

Benzo[b]thiophene-2-carboxylic acid, 3-chloro-6-fluoro-, 2-[4,5-dihydro-5-(4-methoxyphenyl)-3-phenyl-1H-pyrazol-1-yl]-2-oxoethyl ester (9CI)

Benzo[b]thiophene-2-carboxylic acid, 3-chloro-6-fluoro-, 2-[4,5-dihydro-5-(4-methoxyphenyl)-3-phenyl-1H-pyrazol-1-yl]-2-oxoethyl ester (9CI) structure

Benzo[b]thiophene-2-carboxylic acid, 3-chloro-6-fluoro-, 2-[4,5-dihydro-5-(4-methoxyphenyl)-3-phenyl-1H-pyrazol-1-yl]-2-oxoethyl ester (9CI) 

structure
  • CAS No:

    587835-11-8

  • Formula:

    C27H20ClFN2O4S

  • Chemical Name:

    Benzo[b]thiophene-2-carboxylic acid, 3-chloro-6-fluoro-, 2-[4,5-dihydro-5-(4-methoxyphenyl)-3-phenyl-1H-pyrazol-1-yl]-2-oxoethyl ester (9CI)

  • Synonyms:

    2-[5-(4-Methoxyphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl 3-chloro-6-fluoro-1-benzo[b]thiophene-2-carboxylate

Benzo[b]thiophene-2-carboxylic acid, 3-chloro-6-fluoro-, 2-[4,5-dihydro-5-(4-methoxyphenyl)-3-phenyl-1H-pyrazol-1-yl]-2-oxoethyl ester (9CI) Basic Attributes

522.9751032

522.082

Characteristics

96.4

6.3

Computed Properties

Molecular Weight:523.0
XLogP3:6.3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:522.0816342
Monoisotopic Mass:522.0816342
Topological Polar Surface Area:96.4
Heavy Atom Count:36
Complexity:833
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of Benzo[b]thiophene-2-carboxylic acid, 3-chloro-6-fluoro-, 2-[4,5-dihydro-5-(4-methoxyphenyl)-3-phenyl-1H-pyrazol-1-yl]-2-oxoethyl ester (9CI)

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