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Home > Encyclopedia > methyl (2S)-2-(1,3-benzodioxol-5-ylmethylcarbamoylamino)-3-phenylpropanoate

methyl (2S)-2-(1,3-benzodioxol-5-ylmethylcarbamoylamino)-3-phenylpropanoate

methyl (2S)-2-(1,3-benzodioxol-5-ylmethylcarbamoylamino)-3-phenylpropanoate structure

methyl (2S)-2-(1,3-benzodioxol-5-ylmethylcarbamoylamino)-3-phenylpropanoate 

structure
  • CAS No:

    956040-98-5

  • Formula:

    C19H20N2O5

  • Chemical Name:

    methyl (2S)-2-(1,3-benzodioxol-5-ylmethylcarbamoylamino)-3-phenylpropanoate

  • Synonyms:

    ZINC2104293;STL533314;AKOS030499593;MCULE-6952335276;methyl N-[(1,3-benzodioxol-5-ylmethyl)carbamoyl]-L-phenylalaninate;956040-98-5

methyl (2S)-2-(1,3-benzodioxol-5-ylmethylcarbamoylamino)-3-phenylpropanoate Basic Attributes

356.4 g/mol

356.13722174 g/mol

Characteristics

85.9 Ų

Computed Properties

Molecular Weight:356.4
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:356.13722174
Monoisotopic Mass:356.13722174
Topological Polar Surface Area:85.9
Heavy Atom Count:26
Complexity:481
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of methyl (2S)-2-(1,3-benzodioxol-5-ylmethylcarbamoylamino)-3-phenylpropanoate

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