N-Benzyltryptamine
TL;DR: N-Benzyltryptamine (CAS 15741-79-4) is a chemical compound with molecular formula C17H18N2 and molecular weight 250.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-2-(1H-indol-3-yl)ethanamine
Also Known As: n-benzyltryptamine, N-Benzyl-1H-indole-3-ethylamine, N-benzyl-2-(1H-indol-3-yl)ethanamine, N-benzyl-tryptamine, Benzyl-[2-(1H-indol-3-yl)-ethyl]-amine
| Molecular Formula | C17H18N2 |
|---|---|
| Molecular Weight | 250.15 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 27.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 250.147 |
| Heavy Atoms | 19 |
| Complexity | 260.0 |
| Solubility | 37.2 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 15741-79-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNCCC2=CNC3=CC=CC=C32 |
| InChIKey | PRRZWJAGZHENJJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Benzyltryptamine (CAS 15741-79-4), with molecular formula C17H18N2 and molecular weight 250.15 g/mol. IUPAC: N-benzyl-2-(1H-indol-3-yl)ethanamine.
Chemical Property Profile of N-Benzyltryptamine
Property Insights of N-Benzyltryptamine
The XLogP value of 3.6 indicates that N-Benzyltryptamine 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-Benzyltryptamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Benzyltryptamine has 2 hydrogen bond donor(s) and 1 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-Benzyltryptamine?
The CAS number of N-Benzyltryptamine is 15741-79-4.
What is the molecular formula of N-Benzyltryptamine?
The molecular formula of N-Benzyltryptamine is C17H18N2.
What is the molecular weight of N-Benzyltryptamine?
The molecular weight of N-Benzyltryptamine is 250.15 g/mol.
Where can I buy N-Benzyltryptamine?
You can request a quote for N-Benzyltryptamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzyltryptamine?
Yes, KEHONG BIO provides custom synthesis services for N-Benzyltryptamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.