chempirical

Cefoperazone sodium

C25H26N9NaO8S2CAS 62893-20-3667.65 g/mol

Open in Covalent MOL file
NNONHONHONO−OSNNNNSHOOONa+
AlkeneAmideCarboxylic acidLactamPhenolSulfide

Properties

Molecular formula
C25H26N9NaO8S2
Molar mass
667.65 g/mol
Exact mass
667.1243 Da
logP
-0.45Crippen estimate
Polar surface area
227.2 Ų
H-bond donors / acceptors
4 / 12
Rotatable bonds
9
Stereocentres
R, R, Rin SMILES atom order

Identifiers

CAS number
62893-20-3
SMILES
CCN1CCN(C(=O)N[C@@H](C(=O)N[C@@H]2C(=O)N3C(C([O-])=O)=C(CSc4nnnn4C)CS[C@H]23)c2ccc(O)cc2)C(=O)C1=O.[Na+]
InChIKey
NMANBWFYJSWTBZ-WERGMSTESA-N
InChI
InChI=1S/C25H27N9O8S2.Na/c1-3-32-8-9-33(21(39)20(32)38)24(42)27-15(12-4-6-14(35)7-5-12)18(36)26-16-19(37)34-17(23(40)41)13(10-43-22(16)34)11-44-25-28-29-30-31(25)2;/h4-7,15-16,22,35H,3,8-11H2,1-2H3,(H,26,36)(H,27,42)(H,40,41);/t15-,16-,22-;/m1./s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

24 names · show all
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2R)-2-[[(4-ethyl-2,3-dioxo-1-piperazinyl)carbonyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-, sodium salt (1:1), (6R,7R)-
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[[[(4-ethyl-2,3-dioxo-1-piperazinyl)carbonyl]amino](4-hydroxyphenyl)acetyl]amino]-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-, monosodium salt, [6R-[6α,7β(R*)]]-
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2R)-[[(4-ethyl-2,3-dioxo-1-piperazinyl)carbonyl]amino](4-hydroxyphenyl)acetyl]amino]-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-, monosodium salt, (6R,7R)-
  • T 1551
  • Sodium cefoperazone
  • Cefoperazone sodium salt
  • Perocef
  • Cefobis
  • Peracef
  • CP 52640-2
  • Cefobine
  • Farecef
  • Novobiocyl
  • Bioperazone
  • Kefazon
  • Pathozone
  • Dardum
  • Cefoneg
  • Cefazone
  • Cefosint
  • Tomabef
  • Cefogram
  • Cefomycin
  • Myticef

Work with Cefoperazone sodium

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(6R,7S)-7-[[(2R)-2-[[(4-Ethyl-2,3-dioxo-1-piperazinyl)carbonyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid1315481-36-783 % similar Cefpiramide sodium74849-93-765 % similar Cefamandole sodium30034-03-863 % similar Cefamandole nafate42540-40-960 % similar Cefoperazone62893-19-055 % similar Cefonicid sodium61270-78-849 % similar Piperacillin sodium59703-84-345 % similar Latamoxef sodium64953-12-445 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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