![N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline structure](/static/products/304/304456-61-9.png)
N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline
TL;DR: N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline (CAS 304456-61-9) is a chemical compound with molecular formula C12H9BrN2O2S and molecular weight 323.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-bromothiophen-2-yl)-N-(2-methyl-4-nitrophenyl)methanimine
Also Known As: BAS 00595590, N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline, 1-(5-bromothiophen-2-yl)-N-(2-methyl-4-nitrophenyl)methanimine, (5-Bromo-thiophen-2-ylmethylene)-(2-methyl-4-nitro-phenyl)-amine, 5-[(1E)-2-(2-methyl-4-nitrophenyl)-2-azavinyl]-2-bromothiophene
| Molecular Formula | C12H9BrN2O2S |
|---|---|
| Molecular Weight | 323.96 g/mol |
| LogP | 4.47782 |
| Topological Polar Surface Area | 55.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.95682 |
| Heavy Atoms | 18 |
| Complexity | 622.29004 |
Chemical Identifiers
| CAS Number | 304456-61-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)[N+](=O)[O-])N=CC2=CC=C(S2)Br |
Product Overview
N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline (CAS 304456-61-9), with molecular formula C12H9BrN2O2S and molecular weight 323.96 g/mol. IUPAC: 1-(5-bromothiophen-2-yl)-N-(2-methyl-4-nitrophenyl)methanimine.
Chemical Property Profile of N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline
Property Insights of N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline
The XLogP value of 4.47782 indicates that N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.5 Ų, N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline 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 N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline?
The CAS number of N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline is 304456-61-9.
What is the molecular formula of N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline?
The molecular formula of N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline is C12H9BrN2O2S.
What is the molecular weight of N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline?
The molecular weight of N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline is 323.96 g/mol.
Where can I buy N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline?
You can request a quote for N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[(5-bromo-2-thienyl)methylene]-2-methyl-4-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.