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Home > Encyclopedia > methyl (2R)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]-3-(1H-indol-3-yl)propanoate

methyl (2R)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]-3-(1H-indol-3-yl)propanoate

methyl (2R)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]-3-(1H-indol-3-yl)propanoate structure

methyl (2R)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]-3-(1H-indol-3-yl)propanoate 

structure
  • CAS No:

    956386-31-5

  • Formula:

    C22H22N2O5S

  • Chemical Name:

    methyl (2R)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]-3-(1H-indol-3-yl)propanoate

  • Synonyms:

    ZINC3352293;AKOS034827510;MCULE-2889189853;Z57024121;956386-31-5;methyl (2R)-2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetamido]-3-(1H-indol-3-yl)propanoate

methyl (2R)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]-3-(1H-indol-3-yl)propanoate Basic Attributes

426.5 g/mol

426.12494298 g/mol

Characteristics

115 Ų

Computed Properties

Molecular Weight:426.5
XLogP3:3.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:426.12494298
Monoisotopic Mass:426.12494298
Topological Polar Surface Area:115
Heavy Atom Count:30
Complexity:606
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of methyl (2R)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]-3-(1H-indol-3-yl)propanoate

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