Pharmakon1600-01502423
Basic information
- CAS
60925-61-3- Standard SMILES
NCc1ccccc1CC(=O)NC1C(=O)N2C(C(=O)O)=C(CSc3nnnn3CC(=O)O)CSC12- InChIKey
SLAYUXIURFNXPG-UHFFFAOYSA-N- Molecular formula
- C20H21N7O6S2
- Average molar mass
- 519.6 g/mol
- Monoisotopic mass
- 519.09947376
Names & identifiers
- Preferred name
- Pharmakon1600-01502423
- IUPAC
- 7-[[2-[2-(aminomethyl)phenyl]acetyl]amino]-3-[[1-(carboxymethyl)tetrazol-5-yl]sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
- English name
- Ceforanide
- Molecular formula
- C20H21N7O6S2
- Molecular weight
- 519.55
Names & synonyms
SCHEMBL14303761HMS5084B03Pharmakon1600-01502423NSC760049CCG-213082LS-14775S5081AB01562982_01BRD-A38738672-001-01-3C06884BL-S-786Ceforanide
Show more names
CEFORANIDE (200 MG)Antibiotic BL-S-786Ceforanide USP/EP/BPCeforanide (1097807)Ceforanide, 10 mM in DMSO2-(2,4-Dimethylphenyl)sulfBacterial,inhibit,Antibiotic,Inhibitor,Ceforanide
Database identifiers
- CAS
60925-61-3- PubChem CID
- 5229712
- Nikkaji
- J26.425C
Properties
Computed structural properties
- XLogP
- -3.2
- Topological polar surface area
- 244 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 10
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 905
Physicochemical properties
- Melting point
- 150 ° · >150° (dec)
- Density
- 1.79 · 1.79±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
- solubility
- Aqueous Base (Slightly), DMSO (Slightly, Heated), Methanol (Slightly)
- pka
- 2.52 · 2.52±0.10(Predicted)
- form
- Solid
- color
- White to Pale Brown
- Stability
- Hygroscopic
- InChIKey
- SLAYUXIURFNXPG-CRAIPNDOSA-N
- SMILES
- N12[C@@]([H])([C@H](NC(CC3=CC=CC=C3CN)=O)C1=O)SCC(CSC1N(CC(O)=O)N=NN=1)=C2C(O)=O
- FDA UNII
- 8 M1YF8951V · 8M1YF8951V
- ATC code
- 1 DC11 · J01DC11
- Symbol(GHS)
- 8 · GHS08
- Signal word
- Danger
- Hazard statements
- 317 · H317-H334
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2941906000
- Signal word
- Danger
- Symbol(GHS)
- GHS08
- Hazard statements
- H317-H334
- Precautionary statements
- P261-P280-P284-P304+P340-P342+P311
Chemistry & industry
Applications
DescriptionCeforanide is a second generation cephalosporin with good β-lactamase resistance. It has a serum half-life of about three hours, allowing twice-daily dosing.
UsesCeforanide is a cephalosporin based antibiotic used in the sterilization in various medical procedures.
UsesCephalosporin antibiotic
Additional notes
DefinitionChEBI: A second-generation cephalosporin antibiotic with {[1-(carboxymethyl)-1H-tetrazol-5-yl]sulfanyl}methyl and 2-(aminomethyl)phenylacetamido groups at positions 3 and 7, respectively, of the cephem skeleton. It is effective against many col forms, including Escherichia coli, Klebsiella, Enterobacter and Proteus, and most strains of Salmonella, Shigella, Hemophilus, Citrobacter and Ari ona species.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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