Rufloxacin hydrochlorideProduct ingredient for Rufloxacin

Name
Rufloxacin hydrochloride
Drug Entry
Rufloxacin

Rufloxacin is a quinolone antibiotic. 1

Accession Number
DBSALT002648
Structure
Synonyms
Rufloxacin HCl
External IDs
MF-934
UNII
1643374N6L
CAS Number
106017-08-7
Weight
Average: 399.87
Monoisotopic: 399.0819685
Chemical Formula
C17H19ClFN3O3S
InChI Key
LPQOADBMXVRBNX-UHFFFAOYSA-N
InChI
InChI=1S/C17H18FN3O3S.ClH/c1-19-2-4-20(5-3-19)14-12(18)8-10-13-16(14)25-7-6-21(13)9-11(15(10)22)17(23)24;/h8-9H,2-7H2,1H3,(H,23,24);1H
IUPAC Name
7-fluoro-6-(4-methylpiperazin-1-yl)-10-oxo-4-thia-1-azatricyclo[7.3.1.0^{5,13}]trideca-5(13),6,8,11-tetraene-11-carboxylic acid hydrochloride
SMILES
Cl.CN1CCN(CC1)C1=C(F)C=C2C(=O)C(=CN3CCSC1=C23)C(O)=O
ChemSpider
153337
ChEMBL
CHEMBL1385206
Predicted Properties
PropertyValueSource
Water Solubility0.96 mg/mLALOGPS
logP0.13ALOGPS
logP0.68Chemaxon
logS-2.6ALOGPS
pKa (Strongest Acidic)5.25Chemaxon
pKa (Strongest Basic)6.04Chemaxon
Physiological Charge-1Chemaxon
Hydrogen Acceptor Count6Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area64.09 Å2Chemaxon
Rotatable Bond Count2Chemaxon
Refractivity97.02 m3·mol-1Chemaxon
Polarizability36.67 Å3Chemaxon
Number of Rings4Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon