Mezlocillin sodiumProduct ingredient for Mezlocillin

Name
Mezlocillin sodium
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
DBSALT002350
Structure
Synonyms
Not Available
UNII
RX227TP94U
CAS Number
42057-22-7
Weight
Average: 561.56
Monoisotopic: 561.09639938
Chemical Formula
C21H24N5NaO8S2
InChI Key
GTGQRSIMEUWHPA-ZBJAFUORSA-M
InChI
InChI=1S/C21H25N5O8S2.Na/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);/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
SMILES
[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
ChemSpider
390014
ChEBI
52067
ChEMBL
CHEMBL1697708
Predicted Properties
PropertyValueSource
Water Solubility0.897 mg/mLALOGPS
logP1.66ALOGPS
logP-0.84Chemaxon
logS-2.8ALOGPS
pKa (Strongest Acidic)3.49Chemaxon
pKa (Strongest Basic)-5.9Chemaxon
Physiological Charge-1Chemaxon
Hydrogen Acceptor Count8Chemaxon
Hydrogen Donor Count2Chemaxon
Polar Surface Area176.33 Å2Chemaxon
Rotatable Bond Count5Chemaxon
Refractivity135.72 m3·mol-1Chemaxon
Polarizability51.69 Å3Chemaxon
Number of Rings4Chemaxon
Bioavailability1Chemaxon
Rule of FiveNoChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon