RefChem:84801
TL;DR: RefChem:84801 (CAS 176181-81-0) is a chemical compound with molecular formula C25H25Cl4N3O2S and molecular weight 571.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-aminoethyl)-2,4,5-trichloro-N-[2-[[[(E)-3-(4-chlorophenyl)prop-2-enyl]-methylamino]methyl]phenyl]benzenesulfonamide
Also Known As: HF 2035, N-(2-aminoethyl)-2,4,5-trichloro-N-[2-[[[(E)-3-(4-chlorophenyl)prop-2-enyl]-methylamino]methyl]phenyl]benzenesulfonamide, 2-(N-(2-Aminoethyl)-N-(2,4,5-trichlorobenzenesulfonyl))amino-N-(4-chlorocinnamyl)-N-methylbenzylamine, N-(2-aminoethyl)-2,4,5-trichloro-N-[2-({[(2E)-3-(4-chlorophenyl)prop-2-en-1-yl](methyl)amino}methyl)phenyl]benzene-1-sulfonamide, N-(2-Aminoethyl)-N-[2-[[methyl(4-chloro-trans-cinnamyl)amino]methyl]phenyl]-2,4,5-trichlorobenzenesulfonamide
| Molecular Formula | C25H25Cl4N3O2S |
|---|---|
| Molecular Weight | 571.04 g/mol |
| LogP | 6.5994 |
| Topological Polar Surface Area | 66.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 571.0422 |
| Heavy Atoms | 35 |
| Complexity | 1298.5641 |
Chemical Identifiers
| CAS Number | 176181-81-0 |
|---|---|
| SMILES | CN(C/C=C/C1=CC=C(C=C1)Cl)CC2=CC=CC=C2N(CCN)S(=O)(=O)C3=CC(=C(C=C3Cl)Cl)Cl |
Product Overview
RefChem:84801 (CAS 176181-81-0), with molecular formula C25H25Cl4N3O2S and molecular weight 571.04 g/mol. IUPAC: N-(2-aminoethyl)-2,4,5-trichloro-N-[2-[[[(E)-3-(4-chlorophenyl)prop-2-enyl]-methylamino]methyl]phenyl]benzenesulfonamide.
Chemical Property Profile of RefChem:84801
Property Insights of RefChem:84801
The XLogP value of 6.5994 indicates that RefChem:84801 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.64 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:84801. Following Lipinski's Rule of Five, RefChem:84801 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:84801?
The CAS number of RefChem:84801 is 176181-81-0.
What is the molecular formula of RefChem:84801?
The molecular formula of RefChem:84801 is C25H25Cl4N3O2S.
What is the molecular weight of RefChem:84801?
The molecular weight of RefChem:84801 is 571.04 g/mol.
Where can I buy RefChem:84801?
You can request a quote for RefChem:84801 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:84801?
Yes, KEHONG BIO provides custom synthesis services for RefChem:84801 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.