N-[[(1R,2S,3S,4R)-2,3-bis(2-amino-1H-imidazol-5-yl)-4-[[(4-bromo-1H-pyrrole-2-carbonyl)amino]methyl]cyclobutyl]methyl]-4-bromo-1H-pyrrole-2-carboxamide;dihydrochloride
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![N-[[(1R,2S,3S,4R)-2,3-bis(2-amino-1H-imidazol-5-yl)-4-[[(4-bromo-1H-pyrrole-2-carbonyl)amino]methyl]cyclobutyl]methyl]-4-bromo-1H-pyrrole-2-carboxamide;dihydrochloride structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/e6efce7c26194d469726a63fa3707f98.png "N-[[(1R,2S,3S,4R)-2,3-bis(2-amino-1H-imidazol-5-yl)-4-[[(4-bromo-1H-pyrrole-2-carbonyl)amino]methyl]cyclobutyl]methyl]-4-bromo-1H-pyrrole-2-carboxamide;dihydrochloride")
N-[[(1R,2S,3S,4R)-2,3-bis(2-amino-1H-imidazol-5-yl)-4-[[(4-bromo-1H-pyrrole-2-carbonyl)amino]methyl]cyclobutyl]methyl]-4-bromo-1H-pyrrole-2-carboxamide;dihydrochloride
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CAS No:
79703-25-6
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Formula:
C22H26Br2Cl2N10O2
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Chemical Name:
N-[[(1R,2S,3S,4R)-2,3-bis(2-amino-1H-imidazol-5-yl)-4-[[(4-bromo-1H-pyrrole-2-carbonyl)amino]methyl]cyclobutyl]methyl]-4-bromo-1H-pyrrole-2-carboxamide;dihydrochloride
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Synonyms:
sceptrin;Sceptrin;79703-25-6;N,N'-(((1R,2R,3S,4S)-3,4-bis(2-amino-1H-imidazol-5-yl)cyclobutane-1,2-diyl)bis(methylene))bis(4-bromo-1H-pyrrole-2-carboxamide) dihydrochloride;Sceptrin (HCl);Sceptrin HCl (1:2);CHEMBL515075;DTXSID901000678;1H-Pyrrole-2-carboxamide, N,N'-((3,4-bis(2-amino-1H-imidazol-4-yl)-1,2-cyclobutanediyl)bis(methylene))bis(4-bromo-, dihydrochloride, (1R-(1alpha,2beta,3alpha,4beta))-
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CAS No:
N-[[(1R,2S,3S,4R)-2,3-bis(2-amino-1H-imidazol-5-yl)-4-[[(4-bromo-1H-pyrrole-2-carbonyl)amino]methyl]cyclobutyl]methyl]-4-bromo-1H-pyrrole-2-carboxamide;dihydrochloride Basic Attributes
693.2 g/mol
691.99635 g/mol
Computed Properties
Molecular Weight:693.2
Hydrogen Bond Donor Count:10
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:691.99635
Monoisotopic Mass:689.99840
Topological Polar Surface Area:199
Heavy Atom Count:38
Complexity:747
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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