Cefditoren pivoxilProduct ingredient for Cefditoren
- Name
- Cefditoren pivoxil
- Drug Entry
- Cefditoren
Cefditoren is an oral third-generation cephalosporin. It is commonly marketed under the trade name Spectracef by Cornerstone BioPharma.
- Accession Number
- DBSALT001811
- Structure
Structure for Cefditoren pivoxil (DBSALT001811)
- Synonyms
- CDTR-PI / Cefditoren pivaloyloxymethyl ester
- UNII
- 78THA212DH
- CAS Number
- 117467-28-4
- Weight
- Average: 620.71
Monoisotopic: 620.118160788 - Chemical Formula
- C25H28N6O7S3
- InChI Key
- AFZFFLVORLEPPO-UVYJNCLZSA-N
- InChI
- InChI=1S/C25H28N6O7S3/c1-12-15(41-10-27-12)7-6-13-8-39-21-17(29-19(32)16(30-36-5)14-9-40-24(26)28-14)20(33)31(21)18(13)22(34)37-11-38-23(35)25(2,3)4/h6-7,9-10,17,21H,8,11H2,1-5H3,(H2,26,28)(H,29,32)/b7-6-,30-16-/t17-,21-/m1/s1
- IUPAC Name
- [(6R,7R)-7-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetamido]-3-[(Z)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carbonyloxy]methyl 2,2-dimethylpropanoate
- SMILES
- [H][C@]12SCC(\C=C/C3=C(C)N=CS3)=C(N1C(=O)[C@H]2NC(=O)C(=N/OC)\C1=CSC(N)=N1)C(=O)OCOC(=O)C(C)(C)C
- External Links
- KEGG Drug
- D01628
- ChemSpider
- 4942398
- ChEBI
- 560555
- ChEMBL
- CHEMBL454446
- ZINC
- ZINC000003916973
- Wikipedia
- Cefditoren
- Predicted Properties
Property Value Source Water Solubility 0.0134 mg/mL ALOGPS logP 2.9 ALOGPS logP 2.82 Chemaxon logS -4.7 ALOGPS pKa (Strongest Acidic) 10.82 Chemaxon pKa (Strongest Basic) 4.12 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 9 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 175.4 Å2 Chemaxon Rotatable Bond Count 12 Chemaxon Refractivity 152.9 m3·mol-1 Chemaxon Polarizability 62.65 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 0 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon