RefChem:445066
TL;DR: RefChem:445066 (CAS 64346-99-2) is a chemical compound with molecular formula C94H179N5O4 and molecular weight 1442.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-[2-[2-[2-[2,5-dioxo-3-[(E)-tetracont-1-enyl]pyrrolidin-1-yl]ethylamino]ethylamino]ethylamino]ethyl]-3-[(E)-octatriacont-1-enyl]pyrrolidine-2,5-dione
Also Known As: EINECS 264-820-2, Octatriacontenylsuccinic, tetracontenylsuccinic tetraethylenepentaminediimide, 2,5-Pyrrolidinedione, 1-(2-((2-((2-((2-(2,5-dioxo-3-(tetracontenyl)-1-pyrrolidinyl)ethyl)amino)ethyl)amino)ethyl)amino)ethyl)-3-(octatriacontenyl)-, 2,5-Pyrrolidinedione, 1-(2-((2-((2-((2-(2,5-dioxo-3-(tetraconten-1-yl)-1-pyrrolidinyl)ethyl)amino)ethyl)amino)ethyl)amino)ethyl)-3-(octatriaconten-1-yl)-, 2,5-Pyrrolidinedione, 1-[2-[[2-[[2-[[2-[2,5-dioxo-3-(tetracontenyl)-1-pyrrolidinyl]ethyl]amino]ethyl]amino]ethyl]amino]ethyl]-3-(octatriacontenyl)-
| Molecular Formula | C94H179N5O4 |
|---|---|
| Molecular Weight | 1442.40 g/mol |
| LogP | 27.7448 |
| Topological Polar Surface Area | 110.85 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 86 |
| Exact Mass | 1442.3958 |
| Heavy Atoms | 103 |
| Complexity | 1871.7253 |
Chemical Identifiers
| CAS Number | 64346-99-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC/C=C/C1CC(=O)N(C1=O)CCNCCNCCNCCN2C(=O)CC(C2=O)/C=C/CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC |
Product Overview
RefChem:445066 (CAS 64346-99-2), with molecular formula C94H179N5O4 and molecular weight 1442.40 g/mol. IUPAC: 1-[2-[2-[2-[2-[2,5-dioxo-3-[(E)-tetracont-1-enyl]pyrrolidin-1-yl]ethylamino]ethylamino]ethylamino]ethyl]-3-[(E)-octatriacont-1-enyl]pyrrolidine-2,5-dione.
Chemical Property Profile of RefChem:445066
Property Insights of RefChem:445066
The XLogP value of 27.7448 indicates that RefChem:445066 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.85 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:445066. Following Lipinski's Rule of Five, RefChem:445066 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:445066?
The CAS number of RefChem:445066 is 64346-99-2.
What is the molecular formula of RefChem:445066?
The molecular formula of RefChem:445066 is C94H179N5O4.
What is the molecular weight of RefChem:445066?
The molecular weight of RefChem:445066 is 1442.40 g/mol.
Where can I buy RefChem:445066?
You can request a quote for RefChem:445066 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:445066?
Yes, KEHONG BIO provides custom synthesis services for RefChem:445066 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.