RefChem:341020
TL;DR: RefChem:341020 (CAS 87049-36-3) is a chemical compound with molecular formula C38H52Cl4N4O7 and molecular weight 816.25903 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1-[4-acetyl-3-[2-acetyloxy-3-(4-phenylpiperazin-1-yl)propoxy]phenoxy]-3-(4-phenylpiperazin-1-yl)propan-2-yl] acetate;tetrahydrochloride
Also Known As: Ethanone, 1-(2,4-bis(2-(acetyloxy)-3-(4-phenyl-1-piperazinyl)propoxy)phenyl)-, tetrahydrochloride, 2,4-Bis-(2-acetoxy-3-(N(sub 4)-phenylpiperazinyl)propoxy)acetophenone tetrahydrochloride, [(4-Acetyl-1,3-phenylene)bis(oxy)-3-(4-phenylpiperazin-1-yl)propane-1,2-diyl] diacetate--hydrogen chloride (1/4), [1-[4-acetyl-3-[2-acetyloxy-3-(4-phenylpiperazin-1-yl)propoxy]phenoxy]-3-(4-phenylpiperazin-1-yl)propan-2-yl] acetate tetrahydrochloride
Technical Specifications
| Molecular Formula | C38H52Cl4N4O7 |
| Molecular Weight | 816.25903 g/mol |
| XLogP | 5.84 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 17 |
| Exact Mass | 818.25604 Da |
| Heavy Atoms | 53 |
| Complexity | 1020.0 |
| SMILES | CC(=O)C1=C(C=C(C=C1)OCC(CN2CCN(CC2)C3=CC=CC=C3)OC(=O)C)OCC(CN4CCN(CC4)C5=CC=CC=C5)OC(=O)C.Cl.Cl.Cl.Cl |
| InChIKey | BUYNFDIQLSTINC-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:341020
Property Insights of RefChem:341020
The XLogP value of 5.84 indicates that RefChem:341020 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:341020. Following Lipinski's Rule of Five, RefChem:341020 has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:341020?
The CAS number of RefChem:341020 is 87049-36-3.
What is the molecular formula of RefChem:341020?
The molecular formula of RefChem:341020 is C38H52Cl4N4O7.
What is the molecular weight of RefChem:341020?
The molecular weight of RefChem:341020 is 816.25903 g/mol.
Where can I buy RefChem:341020?
You can request a quote for RefChem:341020 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:341020?
Yes, CoreyChem provides custom synthesis services for RefChem:341020 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.