Ticarcillin disodiumProduct ingredient for Ticarcillin

Name
Ticarcillin disodium
Drug Entry
Ticarcillin

An antibiotic derived from penicillin similar to carbenicillin in action.

Accession Number
DBSALT001159
Structure
Synonyms
Not Available
UNII
G8TVV6DSYG
CAS Number
29457-07-6
Weight
Average: 428.38
Monoisotopic: 428.00886709
Chemical Formula
C15H14N2Na2O6S2
InChI Key
ZBBCUBMBMZNEME-QBGWIPKPSA-L
InChI
InChI=1S/C15H16N2O6S2.2Na/c1-15(2)9(14(22)23)17-11(19)8(12(17)25-15)16-10(18)7(13(20)21)6-3-4-24-5-6;;/h3-5,7-9,12H,1-2H3,(H,16,18)(H,20,21)(H,22,23);;/q;2*+1/p-2/t7-,8-,9+,12-;;/m1../s1
IUPAC Name
disodium (2S,5R,6R)-6-[(2R)-2-carboxy-2-(thiophen-3-yl)acetamido]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
SMILES
[Na+].[Na+].CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](C([O-])=O)C3=CSC=C3)C(=O)N2[C@H]1C([O-])=O
KEGG Compound
C14021
ChemSpider
413136
ChEBI
35017
ChEMBL
CHEMBL1200855
Wikipedia
Ticarcillin
Predicted Properties
PropertyValueSource
Water Solubility0.164 mg/mLALOGPS
logP1.7ALOGPS
logP0.6Chemaxon
logS-3.4ALOGPS
pKa (Strongest Acidic)3.09Chemaxon
pKa (Strongest Basic)-6.3Chemaxon
Physiological Charge-2Chemaxon
Hydrogen Acceptor Count6Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area129.67 Å2Chemaxon
Rotatable Bond Count5Chemaxon
Refractivity109.6 m3·mol-1Chemaxon
Polarizability35.31 Å3Chemaxon
Number of Rings3Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon