Cefadroxil hemihydrateProduct ingredient for Cefadroxil

Name
Cefadroxil hemihydrate
Drug Entry
Cefadroxil

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

Accession Number
DBSALT001743
Structure
Thumb
Synonyms
Not Available
UNII
J9CMF6461M
CAS Number
119922-85-9
Weight
Average: 744.79
Monoisotopic: 744.188348351
Chemical Formula
C32H36N6O11S2
InChI Key
AJAMDISMDZXITN-QXBGZBSVSA-N
InChI
InChI=1S/2C16H17N3O5S.H2O/c2*1-7-6-25-15-11(14(22)19(15)12(7)16(23)24)18-13(21)10(17)8-2-4-9(20)5-3-8;/h2*2-5,10-11,15,20H,6,17H2,1H3,(H,18,21)(H,23,24);1H2/t2*10-,11-,15-;/m11./s1
IUPAC Name
bis((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.CC1=C(N2[C@H](SC1)[C@H](NC(=O)[C@H](N)C1=CC=C(O)C=C1)C2=O)C(O)=O.CC1=C(N2[C@H](SC1)[C@H](NC(=O)[C@H](N)C1=CC=C(O)C=C1)C2=O)C(O)=O
ChemSpider
21230366
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 Count8ChemAxon
Refractivity90.95 m3·mol-1ChemAxon
Polarizability34.01 Å3ChemAxon
Number of Rings6ChemAxon
Bioavailability1ChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleYesChemAxon