1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane
TL;DR: 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane (CAS 56221-19-3) is a chemical compound with molecular formula C18H39N3O6S3 and molecular weight 489.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-tris(pentylsulfonyl)-1,3,5-triazinane
Also Known As: 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane, 1,3,5-Trispentane-sulphonyl-hexahydro-1,3,5-triazine, 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane #, 1,3,5-Tri(pentane-1-sulfonyl)-1,3,5-triazinane, 1,3,5-Triazine, hexahydro-1,3,5-tris(pentylsulfonyl)-
| Molecular Formula | C18H39N3O6S3 |
|---|---|
| Molecular Weight | 489.20 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 137.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 15 |
| Exact Mass | 489.2001 |
| Heavy Atoms | 30 |
| Complexity | 674.0 |
Chemical Identifiers
| CAS Number | 56221-19-3 |
|---|---|
| SMILES | CCCCCS(=O)(=O)N1CN(CN(C1)S(=O)(=O)CCCCC)S(=O)(=O)CCCCC |
| InChIKey | XUSLATRAPHDCEH-UHFFFAOYSA-N |
Product Overview
1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane (CAS 56221-19-3), with molecular formula C18H39N3O6S3 and molecular weight 489.20 g/mol. IUPAC: 1,3,5-tris(pentylsulfonyl)-1,3,5-triazinane.
Chemical Property Profile of 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane
Property Insights of 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane
The XLogP value of 3.5 indicates that 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane. Following Lipinski's Rule of Five, 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane has 0 hydrogen bond donor(s) and 9 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 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane?
The CAS number of 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane is 56221-19-3.
What is the molecular formula of 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane?
The molecular formula of 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane is C18H39N3O6S3.
What is the molecular weight of 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane?
The molecular weight of 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane is 489.20 g/mol.
Where can I buy 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane?
You can request a quote for 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Tris(pentylsulfonyl)-1,3,5-triazinane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.