Molecular Identity
Biapenem
(4R,5S,6S)-3-(6,7-dihydro-5H-pyrazolo[1,2-a][1,2,4]triazol-4-ium-6-ylsulfanyl)-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
PubChem CID: 71339
Biapenem is a carbapenem antibiotic in which the azetidine and pyrroline rings carry 1-hydroxymethyl and pyrazolo[1,2-a][1,2,4]triazolium-6-ylthio substituents respectively. It has a role as an antibacterial drug. It is an organic sulfide, a member of carbapenems and a pyrazolotriazole.
2D Structure
Properties
C15H18N4O4S
Molecular Formula
350.40
Molecular Weight
g/mol
350.1049
Exact Mass
Da
1.4
XLogP
Drug-like (Lipinski: < 5)
128
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
6
H-Bond Acceptors
609
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Biapenem120410-24-4OmegacinL-627LJC-10627LJ C10,627RPX2003CL 186,815CL-186815(4R,5S,6S)-3-(6,7-dihydro-5H-pyrazolo[1,2-a][1,2,4]triazol-4-ium-6-ylsulfanyl)-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylateYR5U3L9ZH1DTXSID5046435LJ-C10627LJC10,627CHEBI:3089
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Biapenem
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