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Home > Encyclopedia > [2-(azepan-1-yl)-2-oxoethyl] 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate

[2-(azepan-1-yl)-2-oxoethyl] 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate

[2-(azepan-1-yl)-2-oxoethyl] 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate structure

[2-(azepan-1-yl)-2-oxoethyl] 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate 

structure
  • CAS No:

    438021-76-2

  • Formula:

    C24H28N2O5S

  • Chemical Name:

    [2-(azepan-1-yl)-2-oxoethyl] 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate

  • Synonyms:

    Oprea1_519096;ZINC3317652;AKOS033638177;MCULE-6757476283;Z18715819;2-(azepan-1-yl)-2-oxoethyl 3-(1,2,3,4-tetrahydroisoquinoline-2-sulfonyl)benzoate;438021-76-2

[2-(azepan-1-yl)-2-oxoethyl] 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate Basic Attributes

456.6 g/mol

456.17189317 g/mol

Characteristics

92.4 Ų

Computed Properties

Molecular Weight:456.6
XLogP3:3.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:456.17189317
Monoisotopic Mass:456.17189317
Topological Polar Surface Area:92.4
Heavy Atom Count:32
Complexity:757
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [2-(azepan-1-yl)-2-oxoethyl] 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzoate

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