![3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole structure](/static/products/7309/730972-73-3.webp)
3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole
TL;DR: 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole (CAS 730972-73-3) is a chemical compound with molecular formula C24H22N2O4 and molecular weight 402.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-(3-methoxy-4-phenylmethoxyphenyl)-2-nitroethyl]-1H-indole
Also Known As: 3-[1-(3-methoxy-4-phenylmethoxyphenyl)-2-nitroethyl]-1H-indole, 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole
| Molecular Formula | C24H22N2O4 |
|---|---|
| Molecular Weight | 402.16 g/mol |
| LogP | 5.1641 |
| Topological Polar Surface Area | 77.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 402.15796 |
| Heavy Atoms | 30 |
| Complexity | 1154.3146 |
Chemical Identifiers
| CAS Number | 730972-73-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C(C[N+](=O)[O-])C2=CNC3=CC=CC=C32)OCC4=CC=CC=C4 |
Product Overview
3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole (CAS 730972-73-3), with molecular formula C24H22N2O4 and molecular weight 402.16 g/mol. IUPAC: 3-[1-(3-methoxy-4-phenylmethoxyphenyl)-2-nitroethyl]-1H-indole.
Chemical Property Profile of 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole
Property Insights of 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole
The XLogP value of 5.1641 indicates that 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole. Following Lipinski's Rule of Five, 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole?
The CAS number of 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole is 730972-73-3.
What is the molecular formula of 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole?
The molecular formula of 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole is C24H22N2O4.
What is the molecular weight of 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole?
The molecular weight of 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole is 402.16 g/mol.
Where can I buy 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole?
You can request a quote for 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-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-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 3-{1-[4-(benzyloxy)-3-methoxyphenyl]-2-nitroethyl}-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.