Cefalotin sodiumProduct ingredient for Cefalotin
- Name
- Cefalotin sodium
- Drug Entry
- Cefalotin
Cefalotin is a cephalosporin antibiotic.
- Accession Number
- DBSALT000262
- Structure
- Synonyms
- Cefalotina sodica / Cephalothin sodium
- External IDs
- Lilly 38253
- UNII
- C22G6EYP8B
- CAS Number
- 58-71-9
- Weight
- Average: 418.41
Monoisotopic: 418.02692284 - Chemical Formula
- C16H15N2NaO6S2
- InChI Key
- VUFGUVLLDPOSBC-XRZFDKQNSA-M
- InChI
- InChI=1S/C16H16N2O6S2.Na/c1-8(19)24-6-9-7-26-15-12(14(21)18(15)13(9)16(22)23)17-11(20)5-10-3-2-4-25-10;/h2-4,12,15H,5-7H2,1H3,(H,17,20)(H,22,23);/q;+1/p-1/t12-,15-;/m1./s1
- IUPAC Name
- sodium (6R,7R)-3-[(acetyloxy)methyl]-8-oxo-7-[2-(thiophen-2-yl)acetamido]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
- SMILES
- [Na+].[H][C@@]1(NC(=O)CC2=CC=CS2)C(=O)N2C(C([O-])=O)=C(COC(C)=O)CS[C@]12[H]
- External Links
- Predicted Properties
Property Value Source Water Solubility 0.116 mg/mL ALOGPS logP 1.04 ALOGPS logP 0.016 Chemaxon logS -3.6 ALOGPS pKa (Strongest Acidic) 3.43 Chemaxon pKa (Strongest Basic) -3.2 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 115.84 Å2 Chemaxon Rotatable Bond Count 7 Chemaxon Refractivity 104.63 m3·mol-1 Chemaxon Polarizability 37.98 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon