Cas no 5115-09-3 (N'-{5-[acetyl(methyl)amino]pentyl}-N-[5-({4-[(5-aminopentyl)(hydroxy)amino]-4-oxobutanoyl}amino)pentyl]-N-hydroxybutanediamide methanesulfonate (1:1))

N'-{5-[acetyl(methyl)amino]pentyl}-N-[5-({4-[(5-aminopentyl)(hydroxy)amino]-4-oxobutanoyl}amino)pentyl]-N-hydroxybutanediamide methanesulfonate (1:1) structure
5115-09-3 structure
Product Name:N'-{5-[acetyl(methyl)amino]pentyl}-N-[5-({4-[(5-aminopentyl)(hydroxy)amino]-4-oxobutanoyl}amino)pentyl]-N-hydroxybutanediamide methanesulfonate (1:1)
CAS No:5115-09-3
MF:C27H54N6O10S
MW:654.816866397858
CID:1570913
PubChem ID:105127
Update Time:2025-04-21

N'-{5-[acetyl(methyl)amino]pentyl}-N-[5-({4-[(5-aminopentyl)(hydroxy)amino]-4-oxobutanoyl}amino)pentyl]-N-hydroxybutanediamide methanesulfonate (1:1) Chemical and Physical Properties

Names and Identifiers

    • N'-{5-[acetyl(methyl)amino]pentyl}-N-[5-({4-[(5-aminopentyl)(hydroxy)amino]-4-oxobutanoyl}amino)pentyl]-N-hydroxybutanediamide methanesulfonate (1:1)
    • 5115-09-3
    • Butanediamide, N'-(5-((4-((5-(acetylhydroxyamino)pentyl)amino)-1,4-dioxobutyl)hydroxyamino)pentyl)-N-(5-aminopentyl)-N-hydroxy-, methanesulfonate (salt)
    • N-(5-{[4-({5-[Acetyl(methyl)amino]pentyl}imino)-4-hydroxybutanoyl](hydroxy)amino}pentyl)-4-[(5-aminopentyl)(hydroxy)amino]-4-oxobutanimidic acid--methanesulfonic acid (1/1)
    • Propionohydroxamic acid, N-(5-(3-((5-aminopentyl)hydroxycarbamoyl)propionamido)pentyl)-3-((5-(N-hydroxyacetamido)pentyl)carbamoyl)-, methanesulfonate (salt)
    • DTXSID80965421
    • Inchi： 1S/C26H50N6O7.CH4O3S/c1-22(33)30(2)19-9-4-7-17-28-23(34)13-15-26(37)32(39)21-11-5-8-18-29-24(35)12-14-25(36)31(38)20-10-3-6-16-27;1-5(2,3)4/h38-39H,3-21,27H2,1-2H3,(H,28,34)(H,29,35);1H3,(H,2,3,4)
    • InChI Key： RKYZLMFFFVLCSW-UHFFFAOYSA-N
    • SMILES： S(C)(=O)(=O)O.ON(C(CCC(NCCCCCN(C(C)=O)C)=O)=O)CCCCCNC(CCC(N(CCCCCN)O)=O)=O

Computed Properties

  • Exact Mass: 654.36252
  • Monoisotopic Mass: 654.362
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 6
  • Hydrogen Bond Acceptor Count: 11
  • Heavy Atom Count: 44
  • Rotatable Bond Count: 23
  • Complexity: 830
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 248?2

Experimental Properties

  • PSA: 239.98

N'-{5-[acetyl(methyl)amino]pentyl}-N-[5-({4-[(5-aminopentyl)(hydroxy)amino]-4-oxobutanoyl}amino)pentyl]-N-hydroxybutanediamide methanesulfonate (1:1) Related Literature

5115-09-3 (N'-{5-[acetyl(methyl)amino]pentyl}-N-[5-({4-[(5-aminopentyl)(hydroxy)amino]-4-oxobutanoyl}amino)pentyl]-N-hydroxybutanediamide methanesulfonate (1:1)) Related Products

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