acetic acid,methyl (2S)-2-(butoxycarbonylamino)-3-[[2-[(5R)-3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]propanoate
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acetic acid,methyl (2S)-2-(butoxycarbonylamino)-3-[[2-[(5R)-3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]propanoate
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CAS No:
176022-59-6
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Formula:
C23H33N5O8
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Chemical Name:
acetic acid,methyl (2S)-2-(butoxycarbonylamino)-3-[[2-[(5R)-3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]propanoate
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Synonyms:
Roxifiban acetate; UNII-0U90EOD13M; DMP-754; Lumaxis;
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CAS No:
acetic acid,methyl (2S)-2-(butoxycarbonylamino)-3-[[2-[(5R)-3-(4-carbamimidoylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]acetyl]amino]propanoate Basic Attributes
507.53700
507.23291303 g/mol
0U90EOD13M
DTXSID90170069
Drug Information
(2S)-3-(2-((5S)-3-(p-amidinophenyl)-2-isoxazolin-5-yl)acetamido)-2-(carboxyamino)propionic acid, 2-butyl methyl ester, monoacetate
Computed Properties
Molecular Weight:507.5
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:13
Exact Mass:507.23291303
Monoisotopic Mass:507.23291303
Topological Polar Surface Area:203
Heavy Atom Count:36
Complexity:736
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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