硫乙拉嗪
TL;DR: 硫乙拉嗪 (CAS 1420-55-9) is a chemical compound with molecular formula C22H29N3S2 and molecular weight 399.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫乙拉嗪
2-ethylsulfanyl-10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine
Also Known As: thiethylperazine, Torecan, Tietilperazina, ETHYLTHIOPERAZINE, Thiethylperazinum
| Molecular Formula | C22H29N3S2 |
|---|---|
| Molecular Weight | 399.18 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 60.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 399.1803 |
| Heavy Atoms | 27 |
| Complexity | 455.0 |
| Melting Point | 62-64 °C |
| Boiling Point | 227 |
| Solubility | 0.0584 |
Chemical Identifiers
| CAS Number | 1420-55-9 |
|---|---|
| SMILES | CCSC1=CC2=C(C=C1)SC3=CC=CC=C3N2CCCN4CCN(CC4)C |
| InChIKey | XCTYLCDETUVOIP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
硫乙拉嗪 (CAS 1420-55-9), with molecular formula C22H29N3S2 and molecular weight 399.18 g/mol. IUPAC: 2-ethylsulfanyl-10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine.
Chemical Property Profile of 硫乙拉嗪
Property Insights of 硫乙拉嗪
The XLogP value of 5.4 indicates that 硫乙拉嗪 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 硫乙拉嗪. Following Lipinski's Rule of Five, 硫乙拉嗪 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 硫乙拉嗪?
The CAS number of 硫乙拉嗪 is 1420-55-9.
What is the molecular formula of 硫乙拉嗪?
The molecular formula of 硫乙拉嗪 is C22H29N3S2.
What is the molecular weight of 硫乙拉嗪?
The molecular weight of 硫乙拉嗪 is 399.18 g/mol.
Where can I buy 硫乙拉嗪?
You can request a quote for 硫乙拉嗪 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫乙拉嗪?
Yes, KEHONG BIO provides custom synthesis services for 硫乙拉嗪 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.