[(1S)-1-carboxy-3-methylsulfanylpropyl]-[2-[[(1S)-1-carboxy-3-methylsulfanylpropyl]amino]-2-oxoacetyl]-bis(4-nitrophenyl)azanium
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![[(1S)-1-carboxy-3-methylsulfanylpropyl]-[2-[[(1S)-1-carboxy-3-methylsulfanylpropyl]amino]-2-oxoacetyl]-bis(4-nitrophenyl)azanium structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2a8f32c7d2634797b8f69b282ca31e76.png "[(1S)-1-carboxy-3-methylsulfanylpropyl]-[2-[[(1S)-1-carboxy-3-methylsulfanylpropyl]amino]-2-oxoacetyl]-bis(4-nitrophenyl)azanium")
[(1S)-1-carboxy-3-methylsulfanylpropyl]-[2-[[(1S)-1-carboxy-3-methylsulfanylpropyl]amino]-2-oxoacetyl]-bis(4-nitrophenyl)azanium
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CAS No:
87498-79-1
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Formula:
C24H27N4O10S2+
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Chemical Name:
[(1S)-1-carboxy-3-methylsulfanylpropyl]-[2-[[(1S)-1-carboxy-3-methylsulfanylpropyl]amino]-2-oxoacetyl]-bis(4-nitrophenyl)azanium
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Synonyms:
oxalyl-(Met-ONP)2;oxalylbis(methionyl-4-nitrophenyl ester);87498-79-1;Oxalyl-(met-onp)2;Oxalylbis(methionyl-4-nitrophenyl ester);DTXSID301007602;L-Methionine, N,N'-(1,2-dioxo-1,2-ethanediyl)bis-, bis(4-nitrophenyl) ester;N-[1-Carboxy-3-(methylsulfanyl)propyl]{[1-carboxy-3-(methylsulfanyl)propyl]imino}hydroxy-N,N-bis(4-nitrophenyl)ethanamidium
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CAS No:
[(1S)-1-carboxy-3-methylsulfanylpropyl]-[2-[[(1S)-1-carboxy-3-methylsulfanylpropyl]amino]-2-oxoacetyl]-bis(4-nitrophenyl)azanium Basic Attributes
595.6 g/mol
595.11686042 g/mol
Computed Properties
Molecular Weight:595.6
XLogP3:3.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:12
Exact Mass:595.11686042
Monoisotopic Mass:595.11686042
Topological Polar Surface Area:263
Heavy Atom Count:40
Formal Charge:1
Complexity:907
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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