1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione
TL;DR: 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione (CAS 334973-49-8) is a chemical compound with molecular formula C21H20N4O4 and molecular weight 392.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione
Also Known As: 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione, 1-(4-benzylpiperazino)-2-(5-nitro-1h-indol-3-yl)ethane-1,2-dione, 1-(4-benzyl-1-piperazinyl)-2-(5-nitro-1h-indol-3-yl)-1,2-ethanedi One, 1-(5-Nitro-1H-indol-3-yl)-2-[4-(phenylmethyl)-1-piperazinyl]-1,2-ethanedione
| Molecular Formula | C21H20N4O4 |
|---|---|
| Molecular Weight | 392.15 g/mol |
| LogP | 2.6032 |
| Topological Polar Surface Area | 99.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 392.14847 |
| Heavy Atoms | 29 |
| Complexity | 1068.7345 |
Chemical Identifiers
| CAS Number | 334973-49-8 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2)C(=O)C(=O)C3=CNC4=C3C=C(C=C4)[N+](=O)[O-] |
Product Overview
1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione (CAS 334973-49-8), with molecular formula C21H20N4O4 and molecular weight 392.15 g/mol. IUPAC: 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione.
Chemical Property Profile of 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione
Property Insights of 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione
The XLogP value of 2.6032 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione. The TPSA of 99.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione. Following Lipinski's Rule of Five, 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione has 1 hydrogen bond donor(s) and 5 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 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione?
The CAS number of 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione is 334973-49-8.
What is the molecular formula of 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione?
The molecular formula of 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione is C21H20N4O4.
What is the molecular weight of 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione?
The molecular weight of 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione is 392.15 g/mol.
Where can I buy 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione?
You can request a quote for 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-benzylpiperazin-1-yl)-2-(5-nitro-1H-indol-3-yl)ethane-1,2-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.