N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide
TL;DR: N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide (CAS 302913-93-5) is a chemical compound with molecular formula C26H42Cl3N3O2S and molecular weight 565.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2,2,2-trichloro-1-[(4-methoxyphenyl)carbamothioylamino]ethyl]hexadecanamide
Also Known As: N-(2,2,2-TRICHLORO-1-(((4-METHOXYANILINO)CARBOTHIOYL)AMINO)ETHYL)HEXADECANAMIDE, N-[2,2,2-trichloro-1-[(4-methoxyphenyl)carbamothioylamino]ethyl]hexadecanamide, N-[2,2,2-trichloro-1-[(4-methoxyphenyl)thiocarbamoylamino]ethyl]hexadecanamide, 658-423-7, RefChem:823714
| Molecular Formula | C26H42Cl3N3O2S |
|---|---|
| Molecular Weight | 565.21 g/mol |
| LogP | 8.2754 |
| Topological Polar Surface Area | 62.39 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 18 |
| Exact Mass | 565.20636 |
| Heavy Atoms | 35 |
| Complexity | 714.7887 |
Chemical Identifiers
| CAS Number | 302913-93-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC1=CC=C(C=C1)OC |
Product Overview
N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide (CAS 302913-93-5), with molecular formula C26H42Cl3N3O2S and molecular weight 565.21 g/mol. IUPAC: N-[2,2,2-trichloro-1-[(4-methoxyphenyl)carbamothioylamino]ethyl]hexadecanamide.
Chemical Property Profile of N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide
Property Insights of N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide
The XLogP value of 8.2754 indicates that N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.39 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide. Following Lipinski's Rule of Five, N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide?
The CAS number of N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide is 302913-93-5.
What is the molecular formula of N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide?
The molecular formula of N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide is C26H42Cl3N3O2S.
What is the molecular weight of N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide?
The molecular weight of N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide is 565.21 g/mol.
Where can I buy N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide?
You can request a quote for N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,2,2-Trichloro-1-(((4-methoxyanilino)carbothioyl)amino)ethyl)hexadecanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.