1-(4-Chloro-3-methylphenyl)sulfonylazepane
TL;DR: 1-(4-Chloro-3-methylphenyl)sulfonylazepane (CAS 325813-84-1) is a chemical compound with molecular formula C13H18ClNO2S and molecular weight 287.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chloro-3-methylphenyl)sulfonylazepane
Also Known As: 1-(4-chloro-3-methylphenyl)sulfonylazepane, 1-(4-chloro-3-methylbenzenesulfonyl)azepane, 1-(4-chloro-3-methyl-phenyl)sulfonylazepane, 1-[(4-chloro-3-methylphenyl)sulfonyl]azepane, AP-263/13383225
| Molecular Formula | C13H18ClNO2S |
|---|---|
| Molecular Weight | 287.07 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.07468 |
| Heavy Atoms | 18 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 325813-84-1 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)Cl |
| InChIKey | WCSZRKNKSHFVRM-UHFFFAOYSA-N |
Product Overview
1-(4-Chloro-3-methylphenyl)sulfonylazepane (CAS 325813-84-1), with molecular formula C13H18ClNO2S and molecular weight 287.07 g/mol. IUPAC: 1-(4-chloro-3-methylphenyl)sulfonylazepane.
Chemical Property Profile of 1-(4-Chloro-3-methylphenyl)sulfonylazepane
Property Insights of 1-(4-Chloro-3-methylphenyl)sulfonylazepane
The XLogP value of 3.3 indicates that 1-(4-Chloro-3-methylphenyl)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-Chloro-3-methylphenyl)sulfonylazepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chloro-3-methylphenyl)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
Frequently Asked Questions
What is the CAS number of 1-(4-Chloro-3-methylphenyl)sulfonylazepane?
The CAS number of 1-(4-Chloro-3-methylphenyl)sulfonylazepane is 325813-84-1.
What is the molecular formula of 1-(4-Chloro-3-methylphenyl)sulfonylazepane?
The molecular formula of 1-(4-Chloro-3-methylphenyl)sulfonylazepane is C13H18ClNO2S.
What is the molecular weight of 1-(4-Chloro-3-methylphenyl)sulfonylazepane?
The molecular weight of 1-(4-Chloro-3-methylphenyl)sulfonylazepane is 287.07 g/mol.
Where can I buy 1-(4-Chloro-3-methylphenyl)sulfonylazepane?
You can request a quote for 1-(4-Chloro-3-methylphenyl)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-Chloro-3-methylphenyl)sulfonylazepane?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chloro-3-methylphenyl)sulfonylazepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.