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Home > Encyclopedia > (4-butyl-6-chloro-2-oxochromen-7-yl) (2S)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate

(4-butyl-6-chloro-2-oxochromen-7-yl) (2S)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate

(4-butyl-6-chloro-2-oxochromen-7-yl) (2S)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate structure

(4-butyl-6-chloro-2-oxochromen-7-yl) (2S)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate 

structure
  • CAS No:

    1173689-31-0

  • Formula:

    C29H28ClNO6S

  • Chemical Name:

    (4-butyl-6-chloro-2-oxochromen-7-yl) (2S)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate

  • Synonyms:

    C29H28ClNO6S;ZINC2149859;STL533224;AKOS037496415;4-butyl-6-chloro-2-oxo-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-phenylalaninate;(S)-4-butyl-6-chloro-2-oxo-2H-chromen-7-yl 2-(4-methylphenylsulfonamido)-3-phenylpropanoate;1173689-31-0

(4-butyl-6-chloro-2-oxochromen-7-yl) (2S)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate Basic Attributes

554.1 g/mol

553.1325865 g/mol

Characteristics

107 Ų

Computed Properties

Molecular Weight:554.1
XLogP3:6.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:11
Exact Mass:553.1325865
Monoisotopic Mass:553.1325865
Topological Polar Surface Area:107
Heavy Atom Count:38
Complexity:949
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of (4-butyl-6-chloro-2-oxochromen-7-yl) (2S)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate

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