![2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione structure](/static/products/714/714243-76-2.png)
2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione
TL;DR: 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione (CAS 714243-76-2) is a chemical compound with molecular formula C18H13N3O4 and molecular weight 335.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-indol-1-ylethyl)-4-nitroisoindole-1,3-dione
Also Known As: 2-(2-indol-1-ylethyl)-4-nitroisoindole-1,3-dione, 2-(2-(1H-indol-1-yl)ethyl)-4-nitroisoindoline-1,3-dione, 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C18H13N3O4 |
|---|---|
| Molecular Weight | 335.09 g/mol |
| LogP | 2.8457 |
| Topological Polar Surface Area | 85.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 335.0906 |
| Heavy Atoms | 25 |
| Complexity | 1037.7322 |
Chemical Identifiers
| CAS Number | 714243-76-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CN2CCN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-] |
Product Overview
2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione (CAS 714243-76-2), with molecular formula C18H13N3O4 and molecular weight 335.09 g/mol. IUPAC: 2-(2-indol-1-ylethyl)-4-nitroisoindole-1,3-dione.
Chemical Property Profile of 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione
Property Insights of 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione
The XLogP value of 2.8457 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione. The TPSA of 85.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione. Following Lipinski's Rule of Five, 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione has 0 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 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione?
The CAS number of 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione is 714243-76-2.
What is the molecular formula of 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione?
The molecular formula of 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione is C18H13N3O4.
What is the molecular weight of 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione?
The molecular weight of 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione is 335.09 g/mol.
Where can I buy 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione?
You can request a quote for 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(1H-indol-1-yl)ethyl]-4-nitro-1H-isoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.