2-amino-5-[[1-(carboxymethylamino)-3-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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![2-amino-5-[[1-(carboxymethylamino)-3-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/823d33c767854050b7a075955c338505.png "2-amino-5-[[1-(carboxymethylamino)-3-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid")
2-amino-5-[[1-(carboxymethylamino)-3-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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CAS No:
33812-53-2
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Formula:
C18H22ClN3O7S
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Chemical Name:
2-amino-5-[[1-(carboxymethylamino)-3-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
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Synonyms:
33812-53-2;NSC131124;SCHEMBL2095725;DTXSID80955403;NSC-131124;5-[(1-[(Carboxymethyl)imino]-3-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-1-hydroxypropan-2-yl)imino]-5-hydroxynorvaline
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CAS No:
2-amino-5-[[1-(carboxymethylamino)-3-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Basic Attributes
459.9 g/mol
459.0866989 g/mol
131124
Computed Properties
Molecular Weight:459.9
XLogP3:-2.1
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:13
Exact Mass:459.0866989
Monoisotopic Mass:459.0866989
Topological Polar Surface Area:201
Heavy Atom Count:30
Complexity:641
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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