![2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate structure](/static/products/1397/1397181-82-6.webp)
2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate
TL;DR: 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate (CAS 1397181-82-6) is a chemical compound with molecular formula C21H27NO10 and molecular weight 453.16348 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2,3,4-triacetyloxy-5-(4-ethoxyanilino)-5-oxopentyl] acetate
Also Known As: 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate, AE-848/11245319, [2,3,4-triacetyloxy-5-(4-ethoxyanilino)-5-oxopentyl] acetate, 5-((4-ethoxyphenyl)amino)-5-oxopentane-1,2,3,4-tetrayl tetraacetate, 5-[(4-ethoxyphenyl)amino]-5-oxopentane-1,2,3,4-tetrayl tetraacetate (non-preferred name)
Technical Specifications
| Molecular Formula | C21H27NO10 |
| Molecular Weight | 453.16348 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 144.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 15 |
| Exact Mass | 453.16348 Da |
| Heavy Atoms | 32 |
| Complexity | 671.0 |
| SMILES | CCOC1=CC=C(C=C1)NC(=O)C(C(C(COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | UHXGPWFXJFJKPE-UHFFFAOYSA-N |
Chemical Property Profile of 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate
Property Insights of 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate. The TPSA of 144.0 Ų indicates high polarity, suggesting 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate?
The CAS number of 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate is 1397181-82-6.
What is the molecular formula of 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate?
The molecular formula of 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate is C21H27NO10.
What is the molecular weight of 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate?
The molecular weight of 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate is 453.16348 g/mol.
Where can I buy 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate?
You can request a quote for 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate?
Yes, CoreyChem provides custom synthesis services for 2-(acetyloxy)-1-[1,2-bis(acetyloxy)ethyl]-3-(4-ethoxyanilino)-3-oxopropyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.