Buclizine hydrochlorideProduct ingredient for Buclizine

Name
Buclizine hydrochloride
Drug Entry
Buclizine

Buclizine is an antihistamine medication with both antiemetic and anticholinergic effects 5, belonging to the piperazine derivative family of drugs. It was manufactured by Stuart Pharms and initially approved by the FDA in 1957.4 Following this, it was touted to be effective as an appetite stimulant in children when administered in the syrup form, however, this indication has not been validated.1 In addition to the above conditions, buclizine has been studied in the treatment of migraine attacks and in the treatment of nausea and vomiting during pregnancy. 2,3

Accession Number
DBSALT000197
Structure
Synonyms
Buclizine HCl
UNII
58FQD093NU
CAS Number
129-74-8
Weight
Average: 505.95
Monoisotopic: 504.186582251
Chemical Formula
C28H35Cl3N2
InChI Key
SDBHDSZKNVDKNU-UHFFFAOYSA-N
InChI
InChI=1S/C28H33ClN2.2ClH/c1-28(2,3)25-13-9-22(10-14-25)21-30-17-19-31(20-18-30)27(23-7-5-4-6-8-23)24-11-15-26(29)16-12-24;;/h4-16,27H,17-21H2,1-3H3;2*1H
IUPAC Name
1-[(4-tert-butylphenyl)methyl]-4-[(4-chlorophenyl)(phenyl)methyl]piperazine dihydrochloride
SMILES
Cl.Cl.CC(C)(C)C1=CC=C(CN2CCN(CC2)C(C2=CC=CC=C2)C2=CC=C(Cl)C=C2)C=C1
PubChem Compound
65463
ChemSpider
58916
ChEBI
61193
ChEMBL
CHEMBL2360580
Wikipedia
Buclizine
Predicted Properties
PropertyValueSource
Water Solubility0.000246 mg/mLALOGPS
logP6.16ALOGPS
logP7.42Chemaxon
logS-6.2ALOGPS
pKa (Strongest Basic)7.6Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count2Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area6.48 Å2Chemaxon
Rotatable Bond Count6Chemaxon
Refractivity133.02 m3·mol-1Chemaxon
Polarizability50.59 Å3Chemaxon
Number of Rings4Chemaxon
Bioavailability0Chemaxon
Rule of FiveNoChemaxon
Ghose FilterNoChemaxon
Veber's RuleYesChemaxon
MDDR-like RuleYesChemaxon