1-(4-Bromophenyl)sulfonylazepane
TL;DR: 1-(4-Bromophenyl)sulfonylazepane (CAS 153439-48-6) is a chemical compound with molecular formula C12H16BrNO2S and molecular weight 317.0085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-bromophenyl)sulfonylazepane
Also Known As: 1-(4-bromophenyl)sulfonylazepane, 1-((4-bromophenyl)sulfonyl)azepane, 1-[(4-Bromobenzene)sulfonyl]homopiperidine, TimTec1_000850, 1-(4-bromobenzenesulfonyl)azepane
Technical Specifications
| Molecular Formula | C12H16BrNO2S |
| Molecular Weight | 317.0085 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 317.0085 Da |
| Heavy Atoms | 17 |
| Complexity | 323.0 |
| SMILES | C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Br |
| InChIKey | CRHZHJNOPUDTDM-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-Bromophenyl)sulfonylazepane
Property Insights of 1-(4-Bromophenyl)sulfonylazepane
The XLogP value of 3.0 indicates that 1-(4-Bromophenyl)sulfonylazepane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 1-(4-Bromophenyl)sulfonylazepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromophenyl)sulfonylazepane has 0 hydrogen bond donor(s) and 3 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-(4-Bromophenyl)sulfonylazepane?
The CAS number of 1-(4-Bromophenyl)sulfonylazepane is 153439-48-6.
What is the molecular formula of 1-(4-Bromophenyl)sulfonylazepane?
The molecular formula of 1-(4-Bromophenyl)sulfonylazepane is C12H16BrNO2S.
What is the molecular weight of 1-(4-Bromophenyl)sulfonylazepane?
The molecular weight of 1-(4-Bromophenyl)sulfonylazepane is 317.0085 g/mol.
Where can I buy 1-(4-Bromophenyl)sulfonylazepane?
You can request a quote for 1-(4-Bromophenyl)sulfonylazepane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Bromophenyl)sulfonylazepane?
Yes, CoreyChem provides custom synthesis services for 1-(4-Bromophenyl)sulfonylazepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.