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Home > Encyclopedia > methyl 2-[[(2S)-2-[[2-[4-[bis(2-chloroethyl)amino]phenyl]acetyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoate;hydrochloride

methyl 2-[[(2S)-2-[[2-[4-[bis(2-chloroethyl)amino]phenyl]acetyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoate;hydrochloride

methyl 2-[[(2S)-2-[[2-[4-[bis(2-chloroethyl)amino]phenyl]acetyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoate;hydrochloride structure

methyl 2-[[(2S)-2-[[2-[4-[bis(2-chloroethyl)amino]phenyl]acetyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoate;hydrochloride 

structure
  • CAS No:

    42575-83-7

  • Formula:

    C25H36Cl3N5O4

  • Chemical Name:

    methyl 2-[[(2S)-2-[[2-[4-[bis(2-chloroethyl)amino]phenyl]acetyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoate;hydrochloride

  • Synonyms:

    42575-83-7;DTXSID20962570;DL-Leucine, N-(N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-L-histidyl)-, methyl ester, monohydrochloride;N-(N-((4-(Bis(2-chloroethyl)amino)phenyl)acetyl)-L-histidyl)-DL-leucine methyl ester, monohydrochloride;2-[(2-{4-[Bis(2-chloroethyl)amino]phenyl}-1-hydroxyethylidene)amino]-3-(1H-imidazol-5-yl)-N-(1-methoxy-4-methyl-1-oxopentan-2-yl)propanimidic acid--hydrogen chloride (1/1)

methyl 2-[[(2S)-2-[[2-[4-[bis(2-chloroethyl)amino]phenyl]acetyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoate;hydrochloride Basic Attributes

576.9 g/mol

575.183288 g/mol

Characteristics

116 Ų

Computed Properties

Molecular Weight:576.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:16
Exact Mass:575.183288
Monoisotopic Mass:575.183288
Topological Polar Surface Area:116
Heavy Atom Count:37
Complexity:685
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

Guide of methyl 2-[[(2S)-2-[[2-[4-[bis(2-chloroethyl)amino]phenyl]acetyl]amino]-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoate;hydrochloride

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