![2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide structure](/static/products/476/476665-27-7.png)
2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide
TL;DR: 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide (CAS 476665-27-7) is a chemical compound with molecular formula C12H18F2N2O2 and molecular weight 260.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-(2,2-difluoroethenyl)-2-oxoazepan-1-yl]butanamide
Also Known As: 2-[6-(2,2-difluoroethenyl)-2-oxoazepan-1-yl]butanamide, 2-[6-(2,2-difluoroethenyl)-2-oxo-azepan-1-yl]butanamide
| Molecular Formula | C12H18F2N2O2 |
|---|---|
| Molecular Weight | 260.13 g/mol |
| LogP | 1.6594 |
| Topological Polar Surface Area | 63.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.13364 |
| Heavy Atoms | 18 |
| Complexity | 353.98657 |
Chemical Identifiers
| CAS Number | 476665-27-7 |
|---|---|
| SMILES | CCC(C(=O)N)N1CC(CCCC1=O)C=C(F)F |
Product Overview
2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide (CAS 476665-27-7), with molecular formula C12H18F2N2O2 and molecular weight 260.13 g/mol. IUPAC: 2-[6-(2,2-difluoroethenyl)-2-oxoazepan-1-yl]butanamide.
Chemical Property Profile of 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide
Property Insights of 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide
The XLogP value of 1.6594 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide. The TPSA of 63.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide. Following Lipinski's Rule of Five, 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide 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 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide?
The CAS number of 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide is 476665-27-7.
What is the molecular formula of 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide?
The molecular formula of 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide is C12H18F2N2O2.
What is the molecular weight of 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide?
The molecular weight of 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide is 260.13 g/mol.
Where can I buy 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide?
You can request a quote for 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[6-(2,2-Difluoroethenyl)-2-oxoazepan-1-yl]butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.