![3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole structure](/static/products/4288/428827-07-0.webp)
3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole
TL;DR: 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole (CAS 428827-07-0) is a chemical compound with molecular formula C20H22N4O2 and molecular weight 350.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole
Also Known As: 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole, 3-{[4-(2-nitrobenzyl)piperazin-1-yl]methyl}-1H-indole, 1-(indol-3-ylmethyl)-4-[(2-nitrophenyl)methyl]piperazine, 3-{[4-(2-NITROBENZYL)PIPERAZINO]METHYL}-1H-INDOLE, 3-({4-[(2-NITROPHENYL)METHYL]PIPERAZIN-1-YL}METHYL)-1H-INDOLE
| Molecular Formula | C20H22N4O2 |
|---|---|
| Molecular Weight | 350.17 g/mol |
| LogP | 3.3939 |
| Topological Polar Surface Area | 65.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.1743 |
| Heavy Atoms | 26 |
| Complexity | 912.825 |
Chemical Identifiers
| CAS Number | 428827-07-0 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2[N+](=O)[O-])CC3=CNC4=CC=CC=C43 |
Product Overview
3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole (CAS 428827-07-0), with molecular formula C20H22N4O2 and molecular weight 350.17 g/mol. IUPAC: 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole.
Chemical Property Profile of 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole
Property Insights of 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole
The XLogP value of 3.3939 indicates that 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.41 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole. Following Lipinski's Rule of Five, 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole has 1 hydrogen bond donor(s) and 4 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-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole?
The CAS number of 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole is 428827-07-0.
What is the molecular formula of 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole?
The molecular formula of 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole is C20H22N4O2.
What is the molecular weight of 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole?
The molecular weight of 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole is 350.17 g/mol.
Where can I buy 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole?
You can request a quote for 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-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-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole?
Yes, KEHONG BIO provides custom synthesis services for 3-[[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methyl]-1H-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.