Latamoxef disodiumProduct ingredient for Latamoxef

Name
Latamoxef disodium
Drug Entry
Latamoxef

Latamoxef is a broad- spectrum beta-lactam antibiotic similar in structure to the cephalosporins except for the substitution of an oxaazabicyclo moiety for the thiaazabicyclo moiety of certain cephalosporins. It has been proposed especially for the meningitides because it passes the blood-brain barrier and for anaerobic infections.

Accession Number
DBSALT001335
Structure
Synonyms
Latamoxef sodium / Moxalactam disodium / Moxalactam sodium
External IDs
LY-127935
UNII
5APW73W3QZ
CAS Number
64953-12-4
Weight
Average: 564.44
Monoisotopic: 564.06513592
Chemical Formula
C20H18N6Na2O9S
InChI Key
GRIXGZQULWMCLU-HUTAOCTPSA-L
InChI
InChI=1S/C20H20N6O9S.2Na/c1-25-19(22-23-24-25)36-8-10-7-35-18-20(34-2,17(33)26(18)13(10)16(31)32)21-14(28)12(15(29)30)9-3-5-11(27)6-4-9;;/h3-6,12,18,27H,7-8H2,1-2H3,(H,21,28)(H,29,30)(H,31,32);;/q;2*+1/p-2/t12?,18-,20+;;/m1../s1
IUPAC Name
disodium (6R,7R)-7-[2-carboxy-2-(4-hydroxyphenyl)acetamido]-7-methoxy-3-{[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]methyl}-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
SMILES
[Na+].[Na+].[H][C@]12OCC(CSC3=NN=NN3C)=C(N1C(=O)[C@]2(NC(=O)C(C([O-])=O)C1=CC=C(O)C=C1)OC)C([O-])=O
ChemSpider
390015
ChEMBL
CHEMBL1200357
Predicted Properties
PropertyValueSource
Water Solubility1.54 mg/mLALOGPS
logP1.27ALOGPS
logP0.17Chemaxon
logS-2.6ALOGPS
pKa (Strongest Acidic)2.81Chemaxon
pKa (Strongest Basic)-1.7Chemaxon
Physiological Charge-2Chemaxon
Hydrogen Acceptor Count12Chemaxon
Hydrogen Donor Count2Chemaxon
Polar Surface Area211.96 Å2Chemaxon
Rotatable Bond Count9Chemaxon
Refractivity155.38 m3·mol-1Chemaxon
Polarizability46.42 Å3Chemaxon
Number of Rings4Chemaxon
Bioavailability0Chemaxon
Rule of FiveNoChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleYesChemaxon