1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate
TL;DR: 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate (CAS 32838-28-1) is a chemical compound with molecular formula C16H29NO5 and molecular weight 315.20456 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[4-(2-ethylhexylamino)-4-oxobutan-2-yl]oxy-4-oxobutanoic acid
Also Known As: butoctamide semisuccinate, Listomin S, Butoctamide, Butoctamide hydrogen succinate, Listomin
Technical Specifications
| Molecular Formula | C16H29NO5 |
| Molecular Weight | 315.20456 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 315.20456 Da |
| Heavy Atoms | 22 |
| Complexity | 356.0 |
| SMILES | CCCCC(CC)CNC(=O)CC(C)OC(=O)CCC(=O)O |
| InChIKey | CQONVBIGUJWUFE-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate
Property Insights of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate. Following Lipinski's Rule of Five, 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate?
The CAS number of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate is 32838-28-1.
What is the molecular formula of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate?
The molecular formula of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate is C16H29NO5.
What is the molecular weight of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate?
The molecular weight of 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate is 315.20456 g/mol.
Where can I buy 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate?
You can request a quote for 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate?
Yes, CoreyChem provides custom synthesis services for 1-(3-((2-Ethylhexyl)amino)-1-methyl-3-oxopropyl) butanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.