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Home > Encyclopedia > 1,3-benzothiazol-2-ylmethyl (2S)-2-[(2-ethoxybenzoyl)amino]-3-methylbutanoate

1,3-benzothiazol-2-ylmethyl (2S)-2-[(2-ethoxybenzoyl)amino]-3-methylbutanoate

1,3-benzothiazol-2-ylmethyl (2S)-2-[(2-ethoxybenzoyl)amino]-3-methylbutanoate structure

1,3-benzothiazol-2-ylmethyl (2S)-2-[(2-ethoxybenzoyl)amino]-3-methylbutanoate 

structure
  • CAS No:

    957013-83-1

  • Formula:

    C22H24N2O4S

  • Chemical Name:

    1,3-benzothiazol-2-ylmethyl (2S)-2-[(2-ethoxybenzoyl)amino]-3-methylbutanoate

  • Synonyms:

    ZINC2640372;AKOS034826914;MCULE-8147246210;Z56978665;(1,3-benzothiazol-2-yl)methyl (2S)-2-[(2-ethoxyphenyl)formamido]-3-methylbutanoate;957013-83-1

1,3-benzothiazol-2-ylmethyl (2S)-2-[(2-ethoxybenzoyl)amino]-3-methylbutanoate Basic Attributes

412.5 g/mol

412.14567842 g/mol

Characteristics

106 Ų

Computed Properties

Molecular Weight:412.5
XLogP3:4.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:412.14567842
Monoisotopic Mass:412.14567842
Topological Polar Surface Area:106
Heavy Atom Count:29
Complexity:559
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 1,3-benzothiazol-2-ylmethyl (2S)-2-[(2-ethoxybenzoyl)amino]-3-methylbutanoate

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