Cerlapirdine HydrochlorideProduct ingredient for Cerlapirdine

Name
Cerlapirdine Hydrochloride
Drug Entry
Cerlapirdine

Cerlapirdine has been investigated for the treatment of Alzheimer Disease.

Accession Number
DBSALT002160
Structure
Synonyms
Not Available
UNII
2VCB4037GE
CAS Number
925447-04-7
Weight
Average: 445.96
Monoisotopic: 445.1226905
Chemical Formula
C22H24ClN3O3S
InChI Key
RNGAZJUESDPASQ-UHFFFAOYSA-N
InChI
InChI=1S/C22H23N3O3S.ClH/c1-25(2)13-6-14-28-17-11-12-20-19(15-17)22(24-23-20)29(26,27)21-10-5-8-16-7-3-4-9-18(16)21;/h3-5,7-12,15H,6,13-14H2,1-2H3,(H,23,24);1H
IUPAC Name
dimethyl(3-{[3-(naphthalene-1-sulfonyl)-1H-indazol-5-yl]oxy}propyl)amine hydrochloride
SMILES
Cl.CN(C)CCCOC1=CC=C2NN=C(C2=C1)S(=O)(=O)C1=C2C=CC=CC2=CC=C1
ChemSpider
28530652
ChEMBL
CHEMBL2105752
Predicted Properties
PropertyValueSource
Water Solubility0.00476 mg/mLALOGPS
logP3.4ALOGPS
logP3.49ChemAxon
logS-4.9ALOGPS
pKa (Strongest Acidic)9.13ChemAxon
pKa (Strongest Basic)7.83ChemAxon
Physiological Charge1ChemAxon
Hydrogen Acceptor Count5ChemAxon
Hydrogen Donor Count1ChemAxon
Polar Surface Area75.29 Å2ChemAxon
Rotatable Bond Count7ChemAxon
Refractivity115.72 m3·mol-1ChemAxon
Polarizability43.36 Å3ChemAxon
Number of Rings4ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleYesChemAxon