![N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide structure](/static/products/850/850593-29-2.png)
N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide
TL;DR: N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide (CAS 850593-29-2) is a chemical compound with molecular formula C15H17N3O3S and molecular weight 319.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-3-nitrobenzamide
Also Known As: VU0504292-1, F2880-0180, N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide, N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-3-nitrobenzamide, N-(2-(dimethylamino)-2-(thiophen-2-yl)ethyl)-3-nitrobenzamide
| Molecular Formula | C15H17N3O3S |
|---|---|
| Molecular Weight | 319.10 g/mol |
| LogP | 2.689 |
| Topological Polar Surface Area | 75.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 319.09906 |
| Heavy Atoms | 22 |
| Complexity | 655.8121 |
Chemical Identifiers
| CAS Number | 850593-29-2 |
|---|---|
| SMILES | CN(C)C(CNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])C2=CC=CS2 |
Product Overview
N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide (CAS 850593-29-2), with molecular formula C15H17N3O3S and molecular weight 319.10 g/mol. IUPAC: N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-3-nitrobenzamide.
Chemical Property Profile of N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide
Property Insights of N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide
The XLogP value of 2.689 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide. The TPSA of 75.48 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide. Following Lipinski's Rule of Five, N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide 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 N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide?
The CAS number of N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide is 850593-29-2.
What is the molecular formula of N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide?
The molecular formula of N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide is C15H17N3O3S.
What is the molecular weight of N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide?
The molecular weight of N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide is 319.10 g/mol.
Where can I buy N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide?
You can request a quote for N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-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)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(dimethylamino)-2-(thiophen-2-yl)ethyl]-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.