chempirical

Cefodizime disodium

C20H18N6Na2O7S4CAS 86329-79-5628.62 g/mol

Open in Covalent MOL file
ONONHONO−OSNO−OSSSNHNHNa+Na+
AlkeneAmideCarboxylic acidLactamOximeSulfide

Properties

Molecular formula
C20H18N6Na2O7S4
Molar mass
628.62 g/mol
Exact mass
627.9915 Da
logP
0.91Crippen estimate
Polar surface area
201.6 Ų
H-bond donors / acceptors
5 / 12
Rotatable bonds
10
Stereocentres
R, Rin SMILES atom order

Identifiers

CAS number
86329-79-5
SMILES
CON=C(C(=O)N[C@@H]1C(=O)N2C(C([O-])=O)=C(CSc3nc(C)c(CC([O-])=O)s3)CS[C@H]12)c1csc(=N)[nH]1.[Na+].[Na+]
InChIKey
AFILJETUDYIPBX-AEKYOGSZSA-N
InChI
InChI=1S/C20H20N6O7S4.2Na/c1-7-10(3-11(27)28)37-20(22-7)36-5-8-4-34-17-13(16(30)26(17)14(8)18(31)32)24-15(29)12(25-33-2)9-6-35-19(21)23-9;;/h6,13,17H,3-5H2,1-2H3,(H2,21,23)(H,24,29)(H,27,28)(H,31,32);;/b25-12-;;/t13-,17-;;/m1../s1

Weigh it out

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

Names and synonyms

10 names
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2Z)-(2-amino-4-thiazolyl)(methoxyimino)acetyl]amino]-3-[[[5-(carboxymethyl)-4-methyl-2-thiazolyl]thio]methyl]-8-oxo-, sodium salt (1:2), (6R,7R)-
  • HR 221
  • S 77-1221B
  • Cefodizime disodium salt
  • Timecef
  • Kenicef
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2-amino-4-thiazolyl)(methoxyimino)acetyl]amino]-3-[[[5-(carboxymethyl)-4-methyl-2-thiazolyl]thio]methyl]-8-oxo-, disodium salt, [6R-[6α,7β(Z)]]-
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2Z)-(2-amino-4-thiazolyl)(methoxyimino)acetyl]amino]-3-[[[5-(carboxymethyl)-4-methyl-2-thiazolyl]thio]methyl]-8-oxo-, disodium salt, (6R,7R)-
  • THR 221
  • Cefodizime sodium

Work with Cefodizime disodium

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

Cefotaxime sodium64485-93-467 % similar Ceftriaxone sodium74578-69-166 % similar Ceftriaxone disodium hemiheptahydrate104376-79-664 % similar Ceftiofur sodium104010-37-964 % similar Cefovecin sodium141195-77-963 % similar Ceftizoxime sodium68401-82-160 % similar Cefodizime69739-16-856 % similar Cefuroxime sodium56238-63-246 % similar

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

Elsewhere

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