RefChem:230959
TL;DR: RefChem:230959 (CAS 110447-62-6) is a chemical compound with molecular formula C28H38Cl2N4O6 and molecular weight 596.21686 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[3-[2-hydroxy-3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-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-(2-hydroxyethyl)-1-piperazinyl)propyl)-, ethyl ester, dihydrochloride, 1-(4-(2-Hydroxyethyl)-1-piperazine-2-propanolo)-3-carbethoxymethyl-5,5-diphenylhydantoin 2HCl, 1-IMIDAZOLIDINEACETIC ACID, 2,5-DIOXO-4,4-DIPHENYL-3-(2-HYDROXY-3-(4-(2-HYDROXYE, Ethyl (3-{2-hydroxy-3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl}-2,5-dioxo-4,4-diphenylimidazolidin-1-yl)acetate--hydrogen chloride (1/2), ethyl 2-[3-[2-hydroxy-3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-2,5-dioxo-4,4-diphenylimidazolidin-1-yl]acetate dihydrochloride
Technical Specifications
| Molecular Formula | C28H38Cl2N4O6 |
| Molecular Weight | 596.21686 g/mol |
| XLogP | 1.57 |
| Topological Polar Surface Area (TPSA) | 114.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 12 |
| Exact Mass | 596.21686 Da |
| Heavy Atoms | 40 |
| Complexity | 787.0 |
| SMILES | CCOC(=O)CN1C(=O)C(N(C1=O)CC(CN2CCN(CC2)CCO)O)(C3=CC=CC=C3)C4=CC=CC=C4.Cl.Cl |
| InChIKey | VOKWQQKVFBZQGR-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:230959
Property Insights of RefChem:230959
The XLogP value of 1.57 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:230959. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:230959. Following Lipinski's Rule of Five, RefChem:230959 has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:230959?
The CAS number of RefChem:230959 is 110447-62-6.
What is the molecular formula of RefChem:230959?
The molecular formula of RefChem:230959 is C28H38Cl2N4O6.
What is the molecular weight of RefChem:230959?
The molecular weight of RefChem:230959 is 596.21686 g/mol.
Where can I buy RefChem:230959?
You can request a quote for RefChem:230959 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:230959?
Yes, CoreyChem provides custom synthesis services for RefChem:230959 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.