Chlorambucil-arachidonic acid conjugate
TL;DR: Chlorambucil-arachidonic acid conjugate (CAS 130676-89-0) is a chemical compound with molecular formula C36H53Cl2NO4 and molecular weight 633.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[4-[bis(2-chloroethyl)amino]phenyl]butanoyloxy]ethyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate
Also Known As: CAAC, Chlorambucil-arachidonic acid conjugate, 2-[4-[4-[bis(2-chloroethyl)amino]phenyl]butanoyloxy]ethyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate, Benzenebutanoic acid, 4-(bis(2-chloroethyl)amino)-, 2-((1-oxo-5,8,11,14-eicosatetraenyl)oxy)ethyl ester, (all-Z)-, RefChem:125262
| Molecular Formula | C36H53Cl2NO4 |
|---|---|
| Molecular Weight | 633.34 g/mol |
| LogP | 9.5254 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 26 |
| Exact Mass | 633.33514 |
| Heavy Atoms | 43 |
| Complexity | 950.502 |
Chemical Identifiers
| CAS Number | 130676-89-0 |
|---|---|
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)OCCOC(=O)CCCC1=CC=C(C=C1)N(CCCl)CCCl |
Product Overview
Chlorambucil-arachidonic acid conjugate (CAS 130676-89-0), with molecular formula C36H53Cl2NO4 and molecular weight 633.34 g/mol. IUPAC: 2-[4-[4-[bis(2-chloroethyl)amino]phenyl]butanoyloxy]ethyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate.
Chemical Property Profile of Chlorambucil-arachidonic acid conjugate
Property Insights of Chlorambucil-arachidonic acid conjugate
The XLogP value of 9.5254 indicates that Chlorambucil-arachidonic acid conjugate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.84 Ų, Chlorambucil-arachidonic acid conjugate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chlorambucil-arachidonic acid conjugate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Chlorambucil-arachidonic acid conjugate?
The CAS number of Chlorambucil-arachidonic acid conjugate is 130676-89-0.
What is the molecular formula of Chlorambucil-arachidonic acid conjugate?
The molecular formula of Chlorambucil-arachidonic acid conjugate is C36H53Cl2NO4.
What is the molecular weight of Chlorambucil-arachidonic acid conjugate?
The molecular weight of Chlorambucil-arachidonic acid conjugate is 633.34 g/mol.
Where can I buy Chlorambucil-arachidonic acid conjugate?
You can request a quote for Chlorambucil-arachidonic acid conjugate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chlorambucil-arachidonic acid conjugate?
Yes, KEHONG BIO provides custom synthesis services for Chlorambucil-arachidonic acid conjugate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.