3-(2-phenylethyl)-1H-indole
TL;DR: 3-(2-phenylethyl)-1H-indole (CAS 5192-14-3) is a chemical compound with molecular formula C16H15N and molecular weight 221.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-phenylethyl)-1H-indole
Also Known As: 3-phenethyl-1H-indole, 3-phenylethylindole, 3-(2-phenylethyl)-1H-indole, J3.247.497G
| Molecular Formula | C16H15N |
|---|---|
| Molecular Weight | 221.12 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 15.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.12045 |
| Heavy Atoms | 17 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 5192-14-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCC2=CNC3=CC=CC=C32 |
| InChIKey | CEGFYUILHMIKCP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2-phenylethyl)-1H-indole (CAS 5192-14-3), with molecular formula C16H15N and molecular weight 221.12 g/mol. IUPAC: 3-(2-phenylethyl)-1H-indole.
Chemical Property Profile of 3-(2-phenylethyl)-1H-indole
Property Insights of 3-(2-phenylethyl)-1H-indole
The XLogP value of 4.4 indicates that 3-(2-phenylethyl)-1H-indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.8 Ų, 3-(2-phenylethyl)-1H-indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-phenylethyl)-1H-indole has 1 hydrogen bond donor(s) and 0 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 3-(2-phenylethyl)-1H-indole?
The CAS number of 3-(2-phenylethyl)-1H-indole is 5192-14-3.
What is the molecular formula of 3-(2-phenylethyl)-1H-indole?
The molecular formula of 3-(2-phenylethyl)-1H-indole is C16H15N.
What is the molecular weight of 3-(2-phenylethyl)-1H-indole?
The molecular weight of 3-(2-phenylethyl)-1H-indole is 221.12 g/mol.
Where can I buy 3-(2-phenylethyl)-1H-indole?
You can request a quote for 3-(2-phenylethyl)-1H-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-phenylethyl)-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-phenylethyl)-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.