Cefadroxil monohydrateProduct ingredient for Cefadroxil

Name
Cefadroxil monohydrate
Drug Entry
Cefadroxil

Long-acting, broad-spectrum, water-soluble, cephalexin derivative.

Accession Number
DBSALT001744
Structure
Thumb
Synonyms
Cefadroxil
UNII
280111G160
CAS Number
66592-87-8
Weight
Average: 381.4
Monoisotopic: 381.099456518
Chemical Formula
C16H19N3O6S
InChI Key
NBFNMSULHIODTC-CYJZLJNKSA-N
InChI
InChI=1S/C16H17N3O5S.H2O/c1-7-6-25-15-11(14(22)19(15)12(7)16(23)24)18-13(21)10(17)8-2-4-9(20)5-3-8;/h2-5,10-11,15,20H,6,17H2,1H3,(H,18,21)(H,23,24);1H2/t10-,11-,15-;/m1./s1
IUPAC Name
(6R,7R)-7-[(2R)-2-amino-2-(4-hydroxyphenyl)acetamido]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid hydrate
SMILES
O.[H][C@]12SCC(C)=C(N1C(=O)[C@H]2NC(=O)[C@H](N)C1=CC=C(O)C=C1)C(O)=O
ChemSpider
43629
ChEBI
53667
Predicted Properties
PropertyValueSource
Water Solubility0.399 mg/mLALOGPS
logP0.51ALOGPS
logP-2.4ChemAxon
logS-3ALOGPS
pKa (Strongest Acidic)3.45ChemAxon
pKa (Strongest Basic)7.22ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count6ChemAxon
Hydrogen Donor Count4ChemAxon
Polar Surface Area132.96 Å2ChemAxon
Rotatable Bond Count4ChemAxon
Refractivity90.95 m3·mol-1ChemAxon
Polarizability35.86 Å3ChemAxon
Number of Rings3ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon