RefChem:230960
TL;DR: RefChem:230960 (CAS 110427-52-6) is a chemical compound with molecular formula C33H40Cl2N4O5 and molecular weight 642.23755 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[3-[3-(4-benzylpiperazin-1-yl)-2-hydroxypropyl]-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate;dihydrochloride
Also Known As: 1-Imidazolidineacetic acid, 2,5-dioxo-4,4-diphenyl-3-(2-hydroxy-3-(4-(phenylmethyl)-1-piperazinyl)propyl)-, ethyl ester, dihydrochloride, ETHYL2-[3-[3-(4-BENZYLPIPERAZIN-1-YL)-2-HYDROXYPROPYL]-2,5-DIOXO-4,4-DIPHENYLIMIDAZOLIDIN-1-YL]ACETATE DIHYDROCHLORIDE, 1-IMIDAZOLIDINEACETIC ACID, 2,5-DIOXO-4,4-DIPHENYL-3-(2-HYDROXY-3-(4-(PHENYLMETH, Ethyl {3-[3-(4-benzylpiperazin-1-yl)-2-hydroxypropyl]-2,5-dioxo-4,4-diphenylimidazolidin-1-yl}acetate--hydrogen chloride (1/2), ethyl 2-[3-[3-(4-benzylpiperazin-1-yl)-2-hydroxypropyl]-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate dihydrochloride
Technical Specifications
| Molecular Formula | C33H40Cl2N4O5 |
| Molecular Weight | 642.23755 g/mol |
| XLogP | 3.78 |
| Topological Polar Surface Area (TPSA) | 93.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 642.23755 Da |
| Heavy Atoms | 44 |
| Complexity | 886.0 |
| SMILES | CCOC(=O)CN1C(=O)C(N(C1=O)CC(CN2CCN(CC2)CC3=CC=CC=C3)O)(C4=CC=CC=C4)C5=CC=CC=C5.Cl.Cl |
| InChIKey | JHXOSTSAPVGGDA-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:230960
Property Insights of RefChem:230960
The XLogP value of 3.78 indicates that RefChem:230960 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.6 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:230960. Following Lipinski's Rule of Five, RefChem:230960 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:230960?
The CAS number of RefChem:230960 is 110427-52-6.
What is the molecular formula of RefChem:230960?
The molecular formula of RefChem:230960 is C33H40Cl2N4O5.
What is the molecular weight of RefChem:230960?
The molecular weight of RefChem:230960 is 642.23755 g/mol.
Where can I buy RefChem:230960?
You can request a quote for RefChem:230960 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:230960?
Yes, CoreyChem provides custom synthesis services for RefChem:230960 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.