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Home > Encyclopedia > [4aR-(4aα,4bβ,6aα,7α,9aβ,9bα)]-2,4a,4b,5,6,6a,7,8,9,9a,9b,10-Dodecahydro-4a,6a-diMethyl-3-oxo-1H-indeno[5,4-f]quinoline-7-carboxylic Acid Methyl Ester

[4aR-(4aα,4bβ,6aα,7α,9aβ,9bα)]-2,4a,4b,5,6,6a,7,8,9,9a,9b,10-Dodecahydro-4a,6a-diMethyl-3-oxo-1H-indeno[5,4-f]quinoline-7-carboxylic Acid Methyl Ester

[4aR-(4aα,4bβ,6aα,7α,9aβ,9bα)]-2,4a,4b,5,6,6a,7,8,9,9a,9b,10-Dodecahydro-4a,6a-diMethyl-3-oxo-1H-indeno[5,4-f]quinoline-7-carboxylic Acid Methyl Ester structure

[4aR-(4aα,4bβ,6aα,7α,9aβ,9bα)]-2,4a,4b,5,6,6a,7,8,9,9a,9b,10-Dodecahydro-4a,6a-diMethyl-3-oxo-1H-indeno[5,4-f]quinoline-7-carboxylic Acid Methyl Ester 

structure
  • CAS No:

    166896-62-4

  • Formula:

    C20H27NO3

  • Chemical Name:

    [4aR-(4aα,4bβ,6aα,7α,9aβ,9bα)]-2,4a,4b,5,6,6a,7,8,9,9a,9b,10-Dodecahydro-4a,6a-diMethyl-3-oxo-1H-indeno[5,4-f]quinoline-7-carboxylic Acid Methyl Ester

  • Synonyms:

    ZINC77312101;3-Oxo-4-aza-5|A-|Androst-1,5-diene-17|A-carboxylic Acid Methyl Ester;3-Oxo-4-azaandrosta-1,5-diene-17beta-carboxylic acid methyl ester;methyl (1S,3aS,3bS,9aR,9bS,11aS)-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,6,9b,10,11-decahydroindeno[5,4-f]quinoline-1-carboxylate

[4aR-(4aα,4bβ,6aα,7α,9aβ,9bα)]-2,4a,4b,5,6,6a,7,8,9,9a,9b,10-Dodecahydro-4a,6a-diMethyl-3-oxo-1H-indeno[5,4-f]quinoline-7-carboxylic Acid Methyl Ester Basic Attributes

329.43328

329.199

Characteristics

55.4

3.7

[4aR-(4aα,4bβ,6aα,7α,9aβ,9bα)]-2,4a,4b,5,6,6a,7,8,9,9a,9b,10-Dodecahydro-4a,6a-diMethyl-3-oxo-1H-indeno[5,4-f]quinoline-7-carboxylic Acid Methyl Ester Use and Manufacturing

Used in the preparation of Finasteride (F342000) impurity.

Computed Properties

Molecular Weight:329.4
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:329.19909372
Monoisotopic Mass:329.19909372
Topological Polar Surface Area:55.4
Heavy Atom Count:24
Complexity:651
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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