Butaperazine
TL;DR: Butaperazine (CAS 653-03-2) is a chemical compound with molecular formula C24H31N3OS and molecular weight 409.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazin-2-yl]butan-1-one
Also Known As: BUTAPERAZINE, Butyrylperazine, Randolectil, Megalectil, Emerex
| Molecular Formula | C24H31N3OS |
|---|---|
| Molecular Weight | 409.22 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 52.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 409.21878 |
| Heavy Atoms | 29 |
| Complexity | 536.0 |
| Melting Point | MP: 180-182 °C /Maleate/ |
| Boiling Point | 270-280 °C @ 0.05 mm Hg |
| Solubility | 1 G IN 400 ML WATER; SOL IN DIMETHYLFORMAMIDE; SPARINGLY SOL IN ALCOHOL & METHANOL; INSOL IN ACETONE, CHLOROFORM, & ETHER /MALEATE/ |
Chemical Identifiers
| CAS Number | 653-03-2 |
|---|---|
| SMILES | CCCC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCN(CC4)C |
| InChIKey | DVLBYTMYSMAKHP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butaperazine (CAS 653-03-2), with molecular formula C24H31N3OS and molecular weight 409.22 g/mol. IUPAC: 1-[10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazin-2-yl]butan-1-one.
Chemical Property Profile of Butaperazine
Property Insights of Butaperazine
The XLogP value of 5.0 indicates that Butaperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.1 Ų, Butaperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butaperazine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Butaperazine?
The CAS number of Butaperazine is 653-03-2.
What is the molecular formula of Butaperazine?
The molecular formula of Butaperazine is C24H31N3OS.
What is the molecular weight of Butaperazine?
The molecular weight of Butaperazine is 409.22 g/mol.
Where can I buy Butaperazine?
You can request a quote for Butaperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butaperazine?
Yes, KEHONG BIO provides custom synthesis services for Butaperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.