5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole
TL;DR: 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole (CAS 690973-83-2) is a chemical compound with molecular formula C19H26N2O4S3 and molecular weight 442.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(azepan-1-yl)-4-(4-methylphenyl)sulfonyl-2-propylsulfonyl-1,3-thiazole
Also Known As: 5-(azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole, 5-(azepan-1-yl)-4-(4-methylphenyl)sulfonyl-2-propylsulfonyl-1,3-thiazole, F0680-0406, 1-[4-(4-METHYLBENZENESULFONYL)-2-(PROPANE-1-SULFONYL)-1,3-THIAZOL-5-YL]AZEPANE, 1-{4-[(4-methylphenyl)sulfonyl]-2-(propylsulfonyl)-1,3-thiazol-5-yl}azepane
| Molecular Formula | C19H26N2O4S3 |
|---|---|
| Molecular Weight | 442.11 g/mol |
| LogP | 3.84842 |
| Topological Polar Surface Area | 84.41 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 442.10547 |
| Heavy Atoms | 28 |
| Complexity | 1017.6311 |
Chemical Identifiers
| CAS Number | 690973-83-2 |
|---|---|
| SMILES | CCCS(=O)(=O)C1=NC(=C(S1)N2CCCCCC2)S(=O)(=O)C3=CC=C(C=C3)C |
Product Overview
5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole (CAS 690973-83-2), with molecular formula C19H26N2O4S3 and molecular weight 442.11 g/mol. IUPAC: 5-(azepan-1-yl)-4-(4-methylphenyl)sulfonyl-2-propylsulfonyl-1,3-thiazole.
Chemical Property Profile of 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole
Property Insights of 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole
The XLogP value of 3.84842 indicates that 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.41 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole. Following Lipinski's Rule of Five, 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole has 0 hydrogen bond donor(s) and 7 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 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole?
The CAS number of 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole is 690973-83-2.
What is the molecular formula of 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole?
The molecular formula of 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole is C19H26N2O4S3.
What is the molecular weight of 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole?
The molecular weight of 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole is 442.11 g/mol.
Where can I buy 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole?
You can request a quote for 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(Azepan-1-yl)-2-(propylsulfonyl)-4-tosylthiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.