Einecs 244-404-7
TL;DR: Einecs 244-404-7 (CAS 21478-01-3) is a chemical compound with molecular formula C28H45Cl2NO6S and molecular weight 593.23444 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[(2,2-dichloroacetyl)amino]-3-hydroxy-3-(4-methylsulfonylphenyl)propyl] hexadecanoate
Also Known As: 2-[(dichloroacetyl)amino]-3-hydroxy-3-[4-(methylsulfonyl)phenyl]propyl hexadecanoate, [2-[(2,2-dichloroacetyl)amino]-3-hydroxy-3-(4-methylsulfonylphenyl)propyl] hexadecanoate, (R-(R*,R*))-2-((Dichloroacetyl)amino)-3-hydroxy-3-(4-(methylsulphonyl)phenyl)propyl palmitate, 2,2-Dichloro-N-{3-(hexadecanoyloxy)-1-hydroxy-1-[4-(methanesulfonyl)phenyl]propan-2-yl}ethanimidic acid, Dichloro-N-{3-(hexadecanoyloxy)-1-hydroxy-1-[4-(methanesulfonyl)phenyl]propan-2-yl}ethanimidic acid
Technical Specifications
| Molecular Formula | C28H45Cl2NO6S |
| Molecular Weight | 593.23444 g/mol |
| XLogP | 7.6 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 22 |
| Exact Mass | 593.23444 Da |
| Heavy Atoms | 38 |
| Complexity | 751.0 |
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC(C(C1=CC=C(C=C1)S(=O)(=O)C)O)NC(=O)C(Cl)Cl |
| InChIKey | MYPUUWZQHGIRSY-UHFFFAOYSA-N |
Chemical Property Profile of Einecs 244-404-7
Property Insights of Einecs 244-404-7
The XLogP value of 7.6 indicates that Einecs 244-404-7 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Einecs 244-404-7. Following Lipinski's Rule of Five, Einecs 244-404-7 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Einecs 244-404-7?
The CAS number of Einecs 244-404-7 is 21478-01-3.
What is the molecular formula of Einecs 244-404-7?
The molecular formula of Einecs 244-404-7 is C28H45Cl2NO6S.
What is the molecular weight of Einecs 244-404-7?
The molecular weight of Einecs 244-404-7 is 593.23444 g/mol.
Where can I buy Einecs 244-404-7?
You can request a quote for Einecs 244-404-7 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Einecs 244-404-7?
Yes, CoreyChem provides custom synthesis services for Einecs 244-404-7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.