1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione
TL;DR: 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione (CAS 109593-19-3) is a chemical compound with molecular formula C17H20N2O2 and molecular weight 284.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione
Also Known As: NIOSH/CM3285000, 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione, 1-((2-Methyl-3-indolyl)oxalyl)hexahydro-1H-azepine, 1H-Azepine, hexahydro-1-((2-methyl-3-indolyl)oxalyl)-, F0675-0254
| Molecular Formula | C17H20N2O2 |
|---|---|
| Molecular Weight | 284.15 g/mol |
| LogP | 3.06162 |
| Topological Polar Surface Area | 53.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.15247 |
| Heavy Atoms | 21 |
| Complexity | 679.15497 |
Chemical Identifiers
| CAS Number | 109593-19-3 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1)C(=O)C(=O)N3CCCCCC3 |
Product Overview
1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione (CAS 109593-19-3), with molecular formula C17H20N2O2 and molecular weight 284.15 g/mol. IUPAC: 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione.
Chemical Property Profile of 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione
Property Insights of 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione
The XLogP value of 3.06162 indicates that 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.17 Ų, 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione?
The CAS number of 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione is 109593-19-3.
What is the molecular formula of 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione?
The molecular formula of 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione is C17H20N2O2.
What is the molecular weight of 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione?
The molecular weight of 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione is 284.15 g/mol.
Where can I buy 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione?
You can request a quote for 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-(azepan-1-yl)-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.