N-(2,2-ditosylvinyl)-4-ethoxyaniline
TL;DR: N-(2,2-ditosylvinyl)-4-ethoxyaniline (CAS 691381-95-0) is a chemical compound with molecular formula C24H25NO5S2 and molecular weight 471.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2,2-bis-(4-methylphenyl)sulfonylethenyl]-4-ethoxyaniline
Also Known As: N-(2,2-ditosylvinyl)-4-ethoxyaniline, (2,2-ditosylethenyl)(p-ethoxyphenyl)amine, F1637-0037, N-[2,2-BIS(4-METHYLBENZENESULFONYL)ETHENYL]-4-ETHOXYANILINE, N-[2,2-bis-(4-methylphenyl)sulfonylethenyl]-4-ethoxyaniline
| Molecular Formula | C24H25NO5S2 |
|---|---|
| Molecular Weight | 471.12 g/mol |
| LogP | 4.86074 |
| Topological Polar Surface Area | 89.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 471.1174 |
| Heavy Atoms | 32 |
| Complexity | 1231.1467 |
Chemical Identifiers
| CAS Number | 691381-95-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC=C(S(=O)(=O)C2=CC=C(C=C2)C)S(=O)(=O)C3=CC=C(C=C3)C |
Product Overview
N-(2,2-ditosylvinyl)-4-ethoxyaniline (CAS 691381-95-0), with molecular formula C24H25NO5S2 and molecular weight 471.12 g/mol. IUPAC: N-[2,2-bis-(4-methylphenyl)sulfonylethenyl]-4-ethoxyaniline.
Chemical Property Profile of N-(2,2-ditosylvinyl)-4-ethoxyaniline
Property Insights of N-(2,2-ditosylvinyl)-4-ethoxyaniline
The XLogP value of 4.86074 indicates that N-(2,2-ditosylvinyl)-4-ethoxyaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.54 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,2-ditosylvinyl)-4-ethoxyaniline. Following Lipinski's Rule of Five, N-(2,2-ditosylvinyl)-4-ethoxyaniline has 1 hydrogen bond donor(s) and 6 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-(2,2-ditosylvinyl)-4-ethoxyaniline?
The CAS number of N-(2,2-ditosylvinyl)-4-ethoxyaniline is 691381-95-0.
What is the molecular formula of N-(2,2-ditosylvinyl)-4-ethoxyaniline?
The molecular formula of N-(2,2-ditosylvinyl)-4-ethoxyaniline is C24H25NO5S2.
What is the molecular weight of N-(2,2-ditosylvinyl)-4-ethoxyaniline?
The molecular weight of N-(2,2-ditosylvinyl)-4-ethoxyaniline is 471.12 g/mol.
Where can I buy N-(2,2-ditosylvinyl)-4-ethoxyaniline?
You can request a quote for N-(2,2-ditosylvinyl)-4-ethoxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,2-ditosylvinyl)-4-ethoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(2,2-ditosylvinyl)-4-ethoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.