布可立嗪
TL;DR: 布可立嗪 (CAS 82-95-1) is a chemical compound with molecular formula C28H33ClN2 and molecular weight 432.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
布可立嗪
1-[(4-tert-butylphenyl)methyl]-4-[(4-chlorophenyl)-phenylmethyl]piperazine
Also Known As: Buclizine, Histabutizine, Histabuticine, Histabutyzine, Buclifen
| Molecular Formula | C28H33ClN2 |
|---|---|
| Molecular Weight | 432.23 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 6.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 432.23322 |
| Heavy Atoms | 31 |
| Complexity | 514.0 |
| Boiling Point | 218 |
| Solubility | 2.46e-04 g/L |
Chemical Identifiers
| CAS Number | 82-95-1 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl |
| InChIKey | MOYGZHXDRJNJEP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
布可立嗪 (CAS 82-95-1), with molecular formula C28H33ClN2 and molecular weight 432.23 g/mol. IUPAC: 1-[(4-tert-butylphenyl)methyl]-4-[(4-chlorophenyl)-phenylmethyl]piperazine.
Chemical Property Profile of 布可立嗪
Property Insights of 布可立嗪
The XLogP value of 7.1 indicates that 布可立嗪 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.5 Ų, 布可立嗪 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 布可立嗪 has 0 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 布可立嗪?
The CAS number of 布可立嗪 is 82-95-1.
What is the molecular formula of 布可立嗪?
The molecular formula of 布可立嗪 is C28H33ClN2.
What is the molecular weight of 布可立嗪?
The molecular weight of 布可立嗪 is 432.23 g/mol.
Where can I buy 布可立嗪?
You can request a quote for 布可立嗪 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 布可立嗪?
Yes, KEHONG BIO provides custom synthesis services for 布可立嗪 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.