Win 18437
TL;DR: Win 18437 (CAS 4121-77-1) is a chemical compound with molecular formula C21H25N3 and molecular weight 319.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-[2-(4-phenylpiperazin-1-yl)ethyl]-1H-indole
Also Known As: 1-(2-(2-Methylindol-2-yl)ethyl)-4-phenylpiperazine, 2-Methyl-3-(2-(4-phenyl-1-piperazinyl)ethyl)indole, 5-23-03-00067 (Beilstein Handbook Reference), 2-Methyl-3-(2-(4-phenyl-1-piperazinyl)ethyl)-1H-indole, 2-methyl-3-[2-(4-phenylpiperazin-1-yl)ethyl]-1H-indole
| Molecular Formula | C21H25N3 |
|---|---|
| Molecular Weight | 319.20 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 22.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.20483 |
| Heavy Atoms | 24 |
| Complexity | 385.0 |
Chemical Identifiers
| CAS Number | 4121-77-1 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1)CCN3CCN(CC3)C4=CC=CC=C4 |
| InChIKey | FVTXUALVQNDJRJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Win 18437 (CAS 4121-77-1), with molecular formula C21H25N3 and molecular weight 319.20 g/mol. IUPAC: 2-methyl-3-[2-(4-phenylpiperazin-1-yl)ethyl]-1H-indole.
Chemical Property Profile of Win 18437
Property Insights of Win 18437
The XLogP value of 4.3 indicates that Win 18437 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.3 Ų, Win 18437 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Win 18437 has 1 hydrogen bond donor(s) and 2 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 Win 18437?
The CAS number of Win 18437 is 4121-77-1.
What is the molecular formula of Win 18437?
The molecular formula of Win 18437 is C21H25N3.
What is the molecular weight of Win 18437?
The molecular weight of Win 18437 is 319.20 g/mol.
Where can I buy Win 18437?
You can request a quote for Win 18437 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Win 18437?
Yes, KEHONG BIO provides custom synthesis services for Win 18437 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.