![1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane structure](/static/products/6449/644957-70-0.webp)
1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane
TL;DR: 1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane (CAS 644957-70-0) is a chemical compound with molecular formula C14H21NO3S and molecular weight 283.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methoxy-3-methylphenyl)sulfonylazepane
Also Known As: 1-[(4-methoxy-3-methylphenyl)sulfonyl]azepane, 1-(4-methoxy-3-methylphenyl)sulfonylazepane, BAS 06704918, 1-((4-methoxy-3-methylphenyl)sulfonyl)azepane, VU0493053-1
| Molecular Formula | C14H21NO3S |
|---|---|
| Molecular Weight | 283.12 g/mol |
| LogP | 2.56832 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.1242 |
| Heavy Atoms | 19 |
| Complexity | 531.6221 |
Chemical Identifiers
| CAS Number | 644957-70-0 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)OC |
Product Overview
1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane (CAS 644957-70-0), with molecular formula C14H21NO3S and molecular weight 283.12 g/mol. IUPAC: 1-(4-methoxy-3-methylphenyl)sulfonylazepane.
Chemical Property Profile of 1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane
Property Insights of 1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane
The XLogP value of 2.56832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane. With a topological polar surface area (TPSA) of 46.61 Ų, 1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane 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-Methoxy-3-methylphenyl)sulfonyl]azepane?
The CAS number of 1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane is 644957-70-0.
What is the molecular formula of 1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane?
The molecular formula of 1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane is C14H21NO3S.
What is the molecular weight of 1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane?
The molecular weight of 1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane is 283.12 g/mol.
Where can I buy 1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane?
You can request a quote for 1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Methoxy-3-methylphenyl)sulfonyl]azepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.