5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid
TL;DR: 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid (CAS 755007-72-8) is a chemical compound with molecular formula C12H21NO3 and molecular weight 227.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(azepan-1-yl)-3-methyl-5-oxopentanoic acid
Also Known As: 5-(azepan-1-yl)-3-methyl-5-oxopentanoic acid, 5-(1-azepanyl)-3-methyl-5-oxopentanoic acid, 5-(azepan-1-yl)-3-methyl-5-oxo-pentanoic Acid, AS-662/43412855
| Molecular Formula | C12H21NO3 |
|---|---|
| Molecular Weight | 227.15 g/mol |
| LogP | 1.8899 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 227.15215 |
| Heavy Atoms | 16 |
| Complexity | 244.64842 |
Chemical Identifiers
| CAS Number | 755007-72-8 |
|---|---|
| SMILES | CC(CC(=O)N1CCCCCC1)CC(=O)O |
Product Overview
5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid (CAS 755007-72-8), with molecular formula C12H21NO3 and molecular weight 227.15 g/mol. IUPAC: 5-(azepan-1-yl)-3-methyl-5-oxopentanoic acid.
Chemical Property Profile of 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid
Property Insights of 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid
The XLogP value of 1.8899 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid. With a topological polar surface area (TPSA) of 57.61 Ų, 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid 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 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid?
The CAS number of 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid is 755007-72-8.
What is the molecular formula of 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid?
The molecular formula of 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid is C12H21NO3.
What is the molecular weight of 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid?
The molecular weight of 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid is 227.15 g/mol.
Where can I buy 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid?
You can request a quote for 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(Azepan-1-yl)-3-methyl-5-oxopentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.