1-(4-Chlorophenyl)sulfonylazepane
TL;DR: 1-(4-Chlorophenyl)sulfonylazepane (CAS 339066-44-3) is a chemical compound with molecular formula C12H16ClNO2S and molecular weight 273.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)sulfonylazepane
Also Known As: 1-(4-chlorophenyl)sulfonylazepane, 1-[(4-chlorophenyl)sulfonyl]azepane, 1-(4-Chlorobenzene-1-sulfonyl)azepane, 1-(azaperhydroepinylsulfonyl)-4-chlorobenzene, 1H-Azepine, 1-[(4-chlorophenyl)sulfonyl]hexahydro-
| Molecular Formula | C12H16ClNO2S |
|---|---|
| Molecular Weight | 273.06 g/mol |
| LogP | 2.9047 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.05902 |
| Heavy Atoms | 17 |
| Complexity | 461.78394 |
Chemical Identifiers
| CAS Number | 339066-44-3 |
|---|---|
| SMILES | C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl |
Product Overview
1-(4-Chlorophenyl)sulfonylazepane (CAS 339066-44-3), with molecular formula C12H16ClNO2S and molecular weight 273.06 g/mol. IUPAC: 1-(4-chlorophenyl)sulfonylazepane.
Chemical Property Profile of 1-(4-Chlorophenyl)sulfonylazepane
Property Insights of 1-(4-Chlorophenyl)sulfonylazepane
The XLogP value of 2.9047 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Chlorophenyl)sulfonylazepane. With a topological polar surface area (TPSA) of 37.38 Ų, 1-(4-Chlorophenyl)sulfonylazepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)sulfonylazepane has 0 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-(4-Chlorophenyl)sulfonylazepane?
The CAS number of 1-(4-Chlorophenyl)sulfonylazepane is 339066-44-3.
What is the molecular formula of 1-(4-Chlorophenyl)sulfonylazepane?
The molecular formula of 1-(4-Chlorophenyl)sulfonylazepane is C12H16ClNO2S.
What is the molecular weight of 1-(4-Chlorophenyl)sulfonylazepane?
The molecular weight of 1-(4-Chlorophenyl)sulfonylazepane is 273.06 g/mol.
Where can I buy 1-(4-Chlorophenyl)sulfonylazepane?
You can request a quote for 1-(4-Chlorophenyl)sulfonylazepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorophenyl)sulfonylazepane?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)sulfonylazepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.