N-(3,5-dinitrophenyl)-5-methoxytryptamine
TL;DR: N-(3,5-dinitrophenyl)-5-methoxytryptamine (CAS 108929-03-9) is a chemical compound with molecular formula C17H16N4O5 and molecular weight 356.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3,5-dinitroaniline
Also Known As: N-(3,5-Dinitrophenyl)-5-methoxytryptamine, N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3,5-dinitro-aniline, RefChem:926739
| Molecular Formula | C17H16N4O5 |
|---|---|
| Molecular Weight | 356.11 g/mol |
| LogP | 3.6475 |
| Topological Polar Surface Area | 123.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 356.11206 |
| Heavy Atoms | 26 |
| Complexity | 950.1937 |
Chemical Identifiers
| CAS Number | 108929-03-9 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)NC=C2CCNC3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N-(3,5-dinitrophenyl)-5-methoxytryptamine (CAS 108929-03-9), with molecular formula C17H16N4O5 and molecular weight 356.11 g/mol. IUPAC: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3,5-dinitroaniline.
Chemical Property Profile of N-(3,5-dinitrophenyl)-5-methoxytryptamine
Property Insights of N-(3,5-dinitrophenyl)-5-methoxytryptamine
The XLogP value of 3.6475 indicates that N-(3,5-dinitrophenyl)-5-methoxytryptamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.33 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,5-dinitrophenyl)-5-methoxytryptamine. Following Lipinski's Rule of Five, N-(3,5-dinitrophenyl)-5-methoxytryptamine has 2 hydrogen bond donor(s) and 6 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-(3,5-dinitrophenyl)-5-methoxytryptamine?
The CAS number of N-(3,5-dinitrophenyl)-5-methoxytryptamine is 108929-03-9.
What is the molecular formula of N-(3,5-dinitrophenyl)-5-methoxytryptamine?
The molecular formula of N-(3,5-dinitrophenyl)-5-methoxytryptamine is C17H16N4O5.
What is the molecular weight of N-(3,5-dinitrophenyl)-5-methoxytryptamine?
The molecular weight of N-(3,5-dinitrophenyl)-5-methoxytryptamine is 356.11 g/mol.
Where can I buy N-(3,5-dinitrophenyl)-5-methoxytryptamine?
You can request a quote for N-(3,5-dinitrophenyl)-5-methoxytryptamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,5-dinitrophenyl)-5-methoxytryptamine?
Yes, KEHONG BIO provides custom synthesis services for N-(3,5-dinitrophenyl)-5-methoxytryptamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.