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Mezlocillin sodium

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  • Name Mezlocillin sodium
  • EINECSN/A
  • CAS No. 59798-30-0
  • DensityN/A
  • PSA210.01000
  • LogP0.10780
  • SolubilitySoluble in water or DMSO
  • Melting PointN/A
  • FormulaC21H24N5NaO8S2
  • Boiling PointN/A
  • Molecular Weight561.5637
  • Flash PointN/A
  • Transport InformationN/A
  • AppearanceWhite to slightly yellow cryst. powder
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 59798-30-0 (Mezlocillin sodium)
  • Hazard SymbolsN/A
  • SynonymsN/A

Mezlocillin sodium Chemical Properties

Molecular Structure of Sodium (2S,5R,6R)-3,3-dimethyl-6-((R)-2-(3-(methylsulfonyl)-2-oxo-1-imidazolidinecarboxamido)-2-phenylacetamido)-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate (CAS NO.59798-30-0):

IUPAC Name: sodium (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[[2-[(2-oxoimidazolidine-1-carbonyl)amino]-2-phenylacetyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate 
Empirical Formula: C21H24N5NaO8S2
Molecular Weight: 561.5637
H bond acceptors: 13
H bond donors: 3
Freely Rotating Bonds: 6
Polar Surface Area: 189.6Å2
Product Categories: Miscellaneous
InChI
InChI=1/C21H25N5O8S2.Na/c1-21(2)14(18(29)30)26-16(28)13(17(26)35-21)22-15(27)12(11-7-5-4-6-8-11)23-19(31)24-9-10-25(20(24)32)36(3,33)34;/h4-8,12-14,17H,9-10H2,1-3H3,(H,22,27)(H,23,31)(H,29,30);/q;+1/p-1
Smiles
N12[C@@H]([C@@H](NC([C@@H](c3ccccc3)NC(N3C(N(S(C)(=O)=O)CC3)=O)=O)=O)C2=O)SC(C)(C)[C@@H]1C(=O)[O-].[Na+]

Mezlocillin sodium Specification

 Sodium (2S,5R,6R)-3,3-dimethyl-6-((R)-2-(3-(methylsulfonyl)-2-oxo-1-imidazolidinecarboxamido)-2-phenylacetamido)-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate , with CAS number of 59798-30-0, can be called 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-6-(((((3-(methylsulfonyl)-2-oxo-1-imidazolidinyl)carbonyl)amino)phenylacetyl)amino)-7-oxo-, monosodium salt, (2S-(2alpha,5alpha,6beta(S*)))- ; Mezlocillin Sodium . It is a white to slightly yellow cryst. powder.

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