N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide
TL;DR: N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide (CAS 54191-43-4) is a chemical compound with molecular formula C12H12Cl5NO2 and molecular weight 376.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide
Also Known As: N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide, ACETAMIDE, THIO-N,N-DIMETHYL-2,2-DIPHENYL-, Acetamide, N,N-bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)-
| Molecular Formula | C12H12Cl5NO2 |
|---|---|
| Molecular Weight | 376.93 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 376.93106 |
| Heavy Atoms | 20 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 54191-43-4 |
|---|---|
| SMILES | C1=C(C(=CC(=C1Cl)Cl)Cl)OCC(=O)N(CCCl)CCCl |
| InChIKey | MAUOFEFDKVACLR-UHFFFAOYSA-N |
Product Overview
N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide (CAS 54191-43-4), with molecular formula C12H12Cl5NO2 and molecular weight 376.93 g/mol. IUPAC: N,N-bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide.
Chemical Property Profile of N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide
Property Insights of N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide
The XLogP value of 4.4 indicates that N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide has 0 hydrogen bond donor(s) and 2 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,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide?
The CAS number of N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide is 54191-43-4.
What is the molecular formula of N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide?
The molecular formula of N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide is C12H12Cl5NO2.
What is the molecular weight of N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide?
The molecular weight of N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide is 376.93 g/mol.
Where can I buy N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide?
You can request a quote for N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-Bis(2-chloroethyl)-2-(2,4,5-trichlorophenoxy)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.