chempirical

Sulbactam pivoxil

C14H21NO7SCAS 69388-79-0347.38 g/mol

Open in Covalent MOL file
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AcetalAmideEsterLactamSulfone

Properties

Molecular formula
C14H21NO7S
Molar mass
347.38 g/mol
Exact mass
347.1039 Da
logP
0.21Crippen estimate
Polar surface area
107.0 Ų
H-bond donors / acceptors
0 / 7
Rotatable bonds
3
Stereocentres
S, Rin SMILES atom order

Identifiers

CAS number
69388-79-0
SMILES
CC(C)(C)C(=O)OCOC(=O)[C@@H]1N2C(=O)C[C@H]2S(=O)(=O)C1(C)C
InChIKey
OHPVYKXTRACOSQ-ZJUUUORDSA-N
InChI
InChI=1S/C14H21NO7S/c1-13(2,3)12(18)22-7-21-11(17)10-14(4,5)23(19,20)9-6-8(16)15(9)10/h9-10H,6-7H2,1-5H3/t9-,10+/m1/s1

Weigh it out

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

Names and synonyms

5 names
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-, (2,2-dimethyl-1-oxopropoxy)methyl ester, 4,4-dioxide, (2S,5R)-
  • 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-, (2,2-dimethyl-1-oxopropoxy)methyl ester, 4,4-dioxide, (2S-cis)-
  • CP 47904
  • (Pivaloyloxy)methyl penicillanate S,S-dioxide
  • Unasyn oral

Work with Sulbactam pivoxil

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

Sulbactam68373-14-854 % similar Sulbactam sodium69388-84-751 % similar Sultamicillin76497-13-745 % similar Sultamicillin tosylate83105-70-839 % similar Tazobactam diphenylmethyl ester89789-07-135 % similar Tazobactam89786-04-934 % similar Tazobactam sodium89785-84-232 % similar Ethyl pivalate3938-95-231 % similar

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

Elsewhere

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