1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone
TL;DR: 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone (CAS 39543-80-1) is a chemical compound with molecular formula C17H23NO4 and molecular weight 305.16272 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[7-[3-(tert-butylamino)-2-hydroxypropoxy]-1-benzofuran-2-yl]ethanone
Also Known As: Bfe 61, BFE61, 2-Acetyl-7-(2-hydroxy-3-tert-butylaminopropoxy)benzofuran, 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone, 1-[7-[3-(tert-butylamino)-2-hydroxypropoxy]-1-benzofuran-2-yl]ethanone
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H23NO4 |
| Molecular Weight | 305.16272 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 71.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 305.16272 Da |
| Heavy Atoms | 22 |
| Complexity | 379.0 |
| SMILES | CC(=O)C1=CC2=C(O1)C(=CC=C2)OCC(CNC(C)(C)C)O |
| InChIKey | SRKJBWACUFBLGI-UHFFFAOYSA-N |
Chemical Property Profile of 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone
Property Insights of 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone. The TPSA of 71.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone. Following Lipinski's Rule of Five, 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone 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-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone?
The CAS number of 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone is 39543-80-1.
What is the molecular formula of 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone?
The molecular formula of 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone is C17H23NO4.
What is the molecular weight of 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone?
The molecular weight of 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone is 305.16272 g/mol.
Where can I buy 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone?
You can request a quote for 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone?
Yes, CoreyChem provides custom synthesis services for 1-(7-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-2-benzofuranyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.