2-amino-N-[1-[(7-amino-1-chloro-2-oxoheptan-3-yl)amino]-1-oxo-3-phenylpropan-2-yl]-3-methylpentanamide
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![2-amino-N-[1-[(7-amino-1-chloro-2-oxoheptan-3-yl)amino]-1-oxo-3-phenylpropan-2-yl]-3-methylpentanamide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/32f159357d1947a2bd3d9ab0b06a7fc9.png "2-amino-N-[1-[(7-amino-1-chloro-2-oxoheptan-3-yl)amino]-1-oxo-3-phenylpropan-2-yl]-3-methylpentanamide")
2-amino-N-[1-[(7-amino-1-chloro-2-oxoheptan-3-yl)amino]-1-oxo-3-phenylpropan-2-yl]-3-methylpentanamide
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CAS No:
126642-86-2
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Formula:
C22H35ClN4O3
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Chemical Name:
2-amino-N-[1-[(7-amino-1-chloro-2-oxoheptan-3-yl)amino]-1-oxo-3-phenylpropan-2-yl]-3-methylpentanamide
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Synonyms:
Ile-Phe-Lys-CH2Cl;isoleucyl-phenylalanyl-lysine chloromethyl ketone;isoleucyl-phenylalanyl-lysine chloromethyl ketone, D-Ile isomer;126642-86-2;Ile-phe-lys-CH2Cl;Isoleucyl-phenylalanyl-lysine chloromethyl ketone;DTXSID80925641;L-Phenylalaninamide, L-isoleucyl-N-(5-amino-1-(chloroacetyl)pentyl)-, (S)-;2-Amino-N-{1-[(7-amino-1-chloro-2-oxoheptan-3-yl)imino]-1-hydroxy-3-phenylpropan-2-yl}-3-methylpentanimidic acid
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CAS No:
2-amino-N-[1-[(7-amino-1-chloro-2-oxoheptan-3-yl)amino]-1-oxo-3-phenylpropan-2-yl]-3-methylpentanamide Basic Attributes
439.0 g/mol
438.2397687 g/mol
Computed Properties
Molecular Weight:439.0
XLogP3:2.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:14
Exact Mass:438.2397687
Monoisotopic Mass:438.2397687
Topological Polar Surface Area:127
Heavy Atom Count:30
Complexity:541
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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