Mezlocillin sodium monohydrateProduct ingredient for Mezlocillin
- Name
- Mezlocillin sodium monohydrate
- Drug Entry
- Mezlocillin
Semisynthetic ampicillin-derived acylureido penicillin. It has been proposed for infections with certain anaerobes and may be useful in inner ear, bile, and CNS infections.
- Accession Number
- DBSALT001339
- Structure
Structure for Mezlocillin sodium monohydrate (DBSALT001339)
- Synonyms
- Not Available
- UNII
- 3CWW8B5904
- CAS Number
- 80495-46-1
- Weight
- Average: 579.57
Monoisotopic: 579.10696407 - Chemical Formula
- C21H26N5NaO9S2
- InChI Key
- CZXDIDROKIDGNE-SYNJJEHYSA-M
- InChI
- InChI=1S/C21H25N5O8S2.Na.H2O/c1-21(2)14(18(29)30)26-16(28)13(17(26)35-21)22-15(27)12(11-7-5-4-6-8-11)23-19(31)24-9-10-25(20(24)32)36(3,33)34;;/h4-8,12-14,17H,9-10H2,1-3H3,(H,22,27)(H,23,31)(H,29,30);;1H2/q;+1;/p-1/t12-,13-,14+,17-;;/m1../s1
- IUPAC Name
- sodium (2S,5R,6R)-6-[(2R)-2-[(3-methanesulfonyl-2-oxoimidazolidine-1-carbonyl)amino]-2-phenylacetamido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate hydrate
- SMILES
- O.[Na+].CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](NC(=O)N3CCN(C3=O)S(C)(=O)=O)C3=CC=CC=C3)C(=O)N2[C@H]1C([O-])=O
- External Links
- ChemSpider
- 571119
- ChEBI
- 52068
- Wikipedia
- Mezlocillin
- Predicted Properties
Property Value Source Water Solubility 0.897 mg/mL ALOGPS logP 1.66 ALOGPS logP -0.84 Chemaxon logS -2.8 ALOGPS pKa (Strongest Acidic) 3.49 Chemaxon pKa (Strongest Basic) -5.9 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 8 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 176.33 Å2 Chemaxon Rotatable Bond Count 5 Chemaxon Refractivity 135.72 m3·mol-1 Chemaxon Polarizability 51.69 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon