1-(2-Fluorophenyl)sulfonylazepane
TL;DR: 1-(2-Fluorophenyl)sulfonylazepane (CAS 613657-03-7) is a chemical compound with molecular formula C12H16FNO2S and molecular weight 257.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-fluorophenyl)sulfonylazepane
Also Known As: 1-(2-fluorophenyl)sulfonylazepane, 1-((2-fluorophenyl)sulfonyl)azepane, 1-(2-fluorobenzenesulfonyl)azepane, 1-[(2-fluorophenyl)sulfonyl]azepane, 1-(2-Fluorobenzene-1-sulfonyl)azepane
| Molecular Formula | C12H16FNO2S |
|---|---|
| Molecular Weight | 257.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.0886 |
| Heavy Atoms | 17 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 613657-03-7 |
|---|---|
| SMILES | C1CCCN(CC1)S(=O)(=O)C2=CC=CC=C2F |
| InChIKey | NSIHAZMQGXAMJI-UHFFFAOYSA-N |
Product Overview
1-(2-Fluorophenyl)sulfonylazepane (CAS 613657-03-7), with molecular formula C12H16FNO2S and molecular weight 257.09 g/mol. IUPAC: 1-(2-fluorophenyl)sulfonylazepane.
Chemical Property Profile of 1-(2-Fluorophenyl)sulfonylazepane
Property Insights of 1-(2-Fluorophenyl)sulfonylazepane
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Fluorophenyl)sulfonylazepane. With a topological polar surface area (TPSA) of 45.8 Ų, 1-(2-Fluorophenyl)sulfonylazepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Fluorophenyl)sulfonylazepane has 0 hydrogen bond donor(s) and 4 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-(2-Fluorophenyl)sulfonylazepane?
The CAS number of 1-(2-Fluorophenyl)sulfonylazepane is 613657-03-7.
What is the molecular formula of 1-(2-Fluorophenyl)sulfonylazepane?
The molecular formula of 1-(2-Fluorophenyl)sulfonylazepane is C12H16FNO2S.
What is the molecular weight of 1-(2-Fluorophenyl)sulfonylazepane?
The molecular weight of 1-(2-Fluorophenyl)sulfonylazepane is 257.09 g/mol.
Where can I buy 1-(2-Fluorophenyl)sulfonylazepane?
You can request a quote for 1-(2-Fluorophenyl)sulfonylazepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Fluorophenyl)sulfonylazepane?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Fluorophenyl)sulfonylazepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.