N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine
TL;DR: N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine (CAS 155503-38-1) is a chemical compound with molecular formula C17H16ClFN2 and molecular weight 302.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-chloro-6-fluorophenyl)methyl]-2-(1H-indol-3-yl)ethanamine
Also Known As: N-Benzyl-(indol-3-ylethyl)-amine der., BAS 12424312, N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine, AB01007381-01, (2-Chloro-6-fluoro-benzyl)-[2-(1H-indol-3-yl)-ethyl]-amine
| Molecular Formula | C17H16ClFN2 |
|---|---|
| Molecular Weight | 302.10 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 27.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 302.0986 |
| Heavy Atoms | 21 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 155503-38-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CCNCC3=C(C=CC=C3Cl)F |
| InChIKey | PLFFNNHALWJMMN-UHFFFAOYSA-N |
Product Overview
N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine (CAS 155503-38-1), with molecular formula C17H16ClFN2 and molecular weight 302.10 g/mol. IUPAC: N-[(2-chloro-6-fluorophenyl)methyl]-2-(1H-indol-3-yl)ethanamine.
Chemical Property Profile of N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine
Property Insights of N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine
The XLogP value of 4.3 indicates that N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.8 Ų, N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine has 2 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 N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine?
The CAS number of N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine is 155503-38-1.
What is the molecular formula of N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine?
The molecular formula of N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine is C17H16ClFN2.
What is the molecular weight of N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine?
The molecular weight of N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine is 302.10 g/mol.
Where can I buy N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine?
You can request a quote for N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-chloro-6-fluorobenzyl)-2-(1H-indol-3-yl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.