![4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide structure](/static/products/852/852413-38-8.png)
4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide
TL;DR: 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide (CAS 852413-38-8) is a chemical compound with molecular formula C17H16N4O3 and molecular weight 324.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(1H-indol-3-yl)ethylamino]-3-nitrobenzamide
Also Known As: 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide, 4-[2-(1H-indol-3-yl)ethylamino]-3-nitrobenzamide, 4-{[2-(1H-indol-3-yl)ethyl]amino}-3-nitrobenzamide
| Molecular Formula | C17H16N4O3 |
|---|---|
| Molecular Weight | 324.12 g/mol |
| LogP | 2.8296 |
| Topological Polar Surface Area | 114.05 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 324.12225 |
| Heavy Atoms | 24 |
| Complexity | 917.0946 |
Chemical Identifiers
| CAS Number | 852413-38-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2)CCNC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-] |
Product Overview
4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide (CAS 852413-38-8), with molecular formula C17H16N4O3 and molecular weight 324.12 g/mol. IUPAC: 4-[2-(1H-indol-3-yl)ethylamino]-3-nitrobenzamide.
Chemical Property Profile of 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide
Property Insights of 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide
The XLogP value of 2.8296 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide. The TPSA of 114.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide. Following Lipinski's Rule of Five, 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide has 3 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 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide?
The CAS number of 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide is 852413-38-8.
What is the molecular formula of 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide?
The molecular formula of 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide is C17H16N4O3.
What is the molecular weight of 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide?
The molecular weight of 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide is 324.12 g/mol.
Where can I buy 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide?
You can request a quote for 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[[2-(1H-Indol-3-yl)ethyl]amino]-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.