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Home > Encyclopedia > propan-2-yl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate

propan-2-yl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate

propan-2-yl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate structure

propan-2-yl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate 

structure
  • CAS No:

    110301-07-0

  • Formula:

    C12H17NO4

  • Chemical Name:

    propan-2-yl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate

  • Synonyms:

    levodopa isopropyl ester;Levodopa isopropyl ester;110301-07-0;L-DOPA Isopropyl Ester;propan-2-yl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate;CHEMBL1823693;DTXSID60149207;3-Hydroxy-L-tyrosine isopropyl ester;ZINC58124713;L-Tyrosine, 3-hydroxy-, 1-methylethyl ester

propan-2-yl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate Basic Attributes

239.27 g/mol

239.11575802 g/mol

DTXSID60149207

Characteristics

92.8 Ų

0.57 (LogP)

Drug Information

levodopa isopropyl ester

Computed Properties

Molecular Weight:239.27
XLogP3:0.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:239.11575802
Monoisotopic Mass:239.11575802
Topological Polar Surface Area:92.8
Heavy Atom Count:17
Complexity:257
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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