Buclizine Hydrochloride
TL;DR: Buclizine Hydrochloride (CAS 129-74-8) is a chemical compound with molecular formula C28H35Cl3N2 and molecular weight 504.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-tert-butylphenyl)methyl]-4-[(4-chlorophenyl)-phenylmethyl]piperazine;dihydrochloride
Also Known As: Buclizine dihydrochloride, Buclizine hydrochloride, Longifene, Buclina, Buclizine HCl
| Molecular Formula | C28H35Cl3N2 |
|---|---|
| Molecular Weight | 504.19 g/mol |
| LogP | 7.39 |
| Topological Polar Surface Area | 6.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 504.18658 |
| Heavy Atoms | 33 |
| Complexity | 514.0 |
Chemical Identifiers
| CAS Number | 129-74-8 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl.Cl.Cl |
| InChIKey | SDBHDSZKNVDKNU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Buclizine Hydrochloride (CAS 129-74-8), with molecular formula C28H35Cl3N2 and molecular weight 504.19 g/mol. IUPAC: 1-[(4-tert-butylphenyl)methyl]-4-[(4-chlorophenyl)-phenylmethyl]piperazine;dihydrochloride.
Chemical Property Profile of Buclizine Hydrochloride
Property Insights of Buclizine Hydrochloride
The XLogP value of 7.39 indicates that Buclizine Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.5 Ų, Buclizine Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Buclizine Hydrochloride has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Buclizine Hydrochloride?
The CAS number of Buclizine Hydrochloride is 129-74-8.
What is the molecular formula of Buclizine Hydrochloride?
The molecular formula of Buclizine Hydrochloride is C28H35Cl3N2.
What is the molecular weight of Buclizine Hydrochloride?
The molecular weight of Buclizine Hydrochloride is 504.19 g/mol.
Where can I buy Buclizine Hydrochloride?
You can request a quote for Buclizine Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Buclizine Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Buclizine Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.