![4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline structure](/static/products/6212/62128-00-1.webp)
4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline
TL;DR: 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline (CAS 62128-00-1) is a chemical compound with molecular formula C13H12N2O3S and molecular weight 276.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-ethoxyphenyl)-1-(5-nitrothiophen-2-yl)methanimine
Also Known As: 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline, BAS 00484881, N-(4-ethoxyphenyl)-1-(5-nitrothiophen-2-yl)methanimine, Benzenamine, 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]-, (4-ethoxyphenyl)[(5-nitro-2-thienyl)methylene]amine
| Molecular Formula | C13H12N2O3S |
|---|---|
| Molecular Weight | 276.06 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 95.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.05685 |
| Heavy Atoms | 19 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 62128-00-1 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N=CC2=CC=C(S2)[N+](=O)[O-] |
| InChIKey | VIOAMLZLMXNMNS-UHFFFAOYSA-N |
Product Overview
4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline (CAS 62128-00-1), with molecular formula C13H12N2O3S and molecular weight 276.06 g/mol. IUPAC: N-(4-ethoxyphenyl)-1-(5-nitrothiophen-2-yl)methanimine.
Chemical Property Profile of 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline
Property Insights of 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline
The XLogP value of 3.7 indicates that 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline. Following Lipinski's Rule of Five, 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline has 0 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 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline?
The CAS number of 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline is 62128-00-1.
What is the molecular formula of 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline?
The molecular formula of 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline is C13H12N2O3S.
What is the molecular weight of 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline?
The molecular weight of 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline is 276.06 g/mol.
Where can I buy 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline?
You can request a quote for 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-ethoxy-N-[(5-nitro-2-thienyl)methylene]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.