(2S)-2-[[(2S)-2-[[(2S)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-4-methylsulfanylbutanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoic acid
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![(2S)-2-[[(2S)-2-[[(2S)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-4-methylsulfanylbutanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/39b69df978b147979f9864ee8111b308.png "(2S)-2-[[(2S)-2-[[(2S)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-4-methylsulfanylbutanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoic acid")
(2S)-2-[[(2S)-2-[[(2S)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-4-methylsulfanylbutanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoic acid
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CAS No:
146935-91-3
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Formula:
C32H42N4O6S2
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Chemical Name:
(2S)-2-[[(2S)-2-[[(2S)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-4-methylsulfanylbutanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoic acid
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Synonyms:
dansMLP;N-dansyl-Met-Leu-Phe;N-dansylMet-Leu-Phe;N-dansylmethionyl-leucyl-phenylalanine;146935-91-3;Dansmlp;N-Dansylmethionyl-leucyl-phenylalanine;N-Dansyl-met-leu-phe;N-dansylMet-Leu-Phe;DTXSID00932978;N-(2-{[2-{[5-(Dimethylamino)naphthalene-1-sulfonyl]amino}-1-hydroxy-4-(methylsulfanyl)butylidene]amino}-1-hydroxy-4-methylpentylidene)phenylalanine
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CAS No:
(2S)-2-[[(2S)-2-[[(2S)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-4-methylsulfanylbutanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoic acid Basic Attributes
642.8 g/mol
642.25457742 g/mol
Computed Properties
Molecular Weight:642.8
XLogP3:5.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:16
Exact Mass:642.25457742
Monoisotopic Mass:642.25457742
Topological Polar Surface Area:179
Heavy Atom Count:44
Complexity:1040
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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