N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide
TL;DR: N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide (CAS 347907-60-2) is a chemical compound with molecular formula C11H15N3O3 and molecular weight 237.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(dimethylamino)ethyl]-4-nitrobenzamide
Also Known As: N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide, N-[2-(dimethylamino)ethyl]-4-nitrobenzamide, N-(2-dimethylaminoethyl)-4-nitrobenzamide, AF-407/31881021, N-[2-(dimethylamino)ethyl](4-nitrophenyl)carboxamide
| Molecular Formula | C11H15N3O3 |
|---|---|
| Molecular Weight | 237.11 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 78.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 237.11134 |
| Heavy Atoms | 17 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 347907-60-2 |
|---|---|
| SMILES | CN(C)CCNC(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | GWRLXLVWHUDABB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide (CAS 347907-60-2), with molecular formula C11H15N3O3 and molecular weight 237.11 g/mol. IUPAC: N-[2-(dimethylamino)ethyl]-4-nitrobenzamide.
Chemical Property Profile of N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide
Property Insights of N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide. The TPSA of 78.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide. Following Lipinski's Rule of Five, N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide 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 N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide?
The CAS number of N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide is 347907-60-2.
What is the molecular formula of N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide?
The molecular formula of N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide is C11H15N3O3.
What is the molecular weight of N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide?
The molecular weight of N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide is 237.11 g/mol.
Where can I buy N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide?
You can request a quote for N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-(Dimethylamino)ethyl)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.