(2S)-2-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]-3-phenylpropanoic acid
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![(2S)-2-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]-3-phenylpropanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d9f76701e6ff4e188ef4d63153fb5408.png "(2S)-2-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]-3-phenylpropanoic acid")
(2S)-2-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]-3-phenylpropanoic acid
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CAS No:
958984-65-1
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Formula:
C18H16N4O4
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Chemical Name:
(2S)-2-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]-3-phenylpropanoic acid
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Synonyms:
MLS000762420;CHEMBL1894728;HMS2742A07;ZINC2357771;STK716949;AKOS005533832;MCULE-7153903952;SMR000415992;N-[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]-L-phenylalanine;(2S)-2-({2-[4-oxo-1,2,3-benzotriazin-3(4H)-yl]acetyl}amino)-3-phenylpropanoic acid;(S)-2-(2-(4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)acetamido)-3-phenylpropanoic acid;(S)-2-[2-(4-Oxo-4H-benzo[d][1,2,3]triazin-3-yl)-acetylamino]-3-phenyl-propionic acid;958984-65-1
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CAS No:
(2S)-2-[[2-(4-oxo-1,2,3-benzotriazin-3-yl)acetyl]amino]-3-phenylpropanoic acid Basic Attributes
352.3 g/mol
352.11715500 g/mol
Computed Properties
Molecular Weight:352.3
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:352.11715500
Monoisotopic Mass:352.11715500
Topological Polar Surface Area:111
Heavy Atom Count:26
Complexity:574
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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