![1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane structure](/static/products/846/846061-73-2.png)
1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane
TL;DR: 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane (CAS 846061-73-2) is a chemical compound with molecular formula C16H20N2O2S2 and molecular weight 336.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(azepan-1-ylsulfonyl)phenyl]-2-methyl-1,3-thiazole
Also Known As: 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane, 4-(3-(azepan-1-ylsulfonyl)phenyl)-2-methylthiazole, 1-{[3-(2-methyl-1,3-thiazol-4-yl)phenyl]sulfonyl}azepane, 1-azepanyl [3-(2-methyl-1,3-thiazol-4-yl)phenyl] sulfone, 4-[3-(azepan-1-ylsulfonyl)phenyl]-2-methyl-1,3-thiazole
| Molecular Formula | C16H20N2O2S2 |
|---|---|
| Molecular Weight | 336.10 g/mol |
| LogP | 3.68322 |
| Topological Polar Surface Area | 50.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 336.09662 |
| Heavy Atoms | 22 |
| Complexity | 745.0112 |
Chemical Identifiers
| CAS Number | 846061-73-2 |
|---|---|
| SMILES | CC1=NC(=CS1)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3 |
Product Overview
1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane (CAS 846061-73-2), with molecular formula C16H20N2O2S2 and molecular weight 336.10 g/mol. IUPAC: 4-[3-(azepan-1-ylsulfonyl)phenyl]-2-methyl-1,3-thiazole.
Chemical Property Profile of 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane
Property Insights of 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane
The XLogP value of 3.68322 indicates that 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.27 Ų, 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane 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-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane?
The CAS number of 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane is 846061-73-2.
What is the molecular formula of 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane?
The molecular formula of 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane is C16H20N2O2S2.
What is the molecular weight of 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane?
The molecular weight of 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane is 336.10 g/mol.
Where can I buy 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane?
You can request a quote for 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-(2-Methyl-thiazol-4-yl)-benzenesulfonyl]-azepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.