2-amino-5-[[3-[(4-bromophenyl)methylsulfanyl]-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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![2-amino-5-[[3-[(4-bromophenyl)methylsulfanyl]-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/212b00dcb4e94890bb6ce10458fca912.png "2-amino-5-[[3-[(4-bromophenyl)methylsulfanyl]-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid")
2-amino-5-[[3-[(4-bromophenyl)methylsulfanyl]-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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CAS No:
31702-37-1
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Formula:
C17H22BrN3O6S
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Chemical Name:
2-amino-5-[[3-[(4-bromophenyl)methylsulfanyl]-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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Synonyms:
S-(4-bromobenzyl)glutathione;S-(p-bromobenzyl)glutathione;31702-37-1;NSC131115;SCHEMBL345986;DTXSID30953656;NSC-131115;2-amino-5-[[3-[(4-bromophenyl)methylsulfanyl]-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid;5-[(3-{[(4-Bromophenyl)methyl]sulfanyl}-1-[(carboxymethyl)imino]-1-hydroxypropan-2-yl)imino]-5-hydroxynorvaline
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CAS No:
2-amino-5-[[3-[(4-bromophenyl)methylsulfanyl]-1-(carboxymethylamino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Basic Attributes
476.3 g/mol
475.04127 g/mol
131115
Computed Properties
Molecular Weight:476.3
XLogP3:-2
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:12
Exact Mass:475.04127
Monoisotopic Mass:475.04127
Topological Polar Surface Area:184
Heavy Atom Count:28
Complexity:557
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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