1,4,8-Triazacycloundecane
TL;DR: 1,4,8-Triazacycloundecane (CAS 36815-43-7) is a chemical compound with molecular formula C8H19N3 and molecular weight 157.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,8-triazacycloundecane
Also Known As: 1,4,8-triazacycloundecane, [11]anen3, KST-1A4280
| Molecular Formula | C8H19N3 |
|---|---|
| Molecular Weight | 157.16 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 36.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 157.1579 |
| Heavy Atoms | 11 |
| Complexity | 75.0 |
Chemical Identifiers
| CAS Number | 36815-43-7 |
|---|---|
| SMILES | C1CNCCCNCCNC1 |
| InChIKey | RITZWEITCIOIEB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4,8-Triazacycloundecane (CAS 36815-43-7), with molecular formula C8H19N3 and molecular weight 157.16 g/mol. IUPAC: 1,4,8-triazacycloundecane.
Chemical Property Profile of 1,4,8-Triazacycloundecane
Property Insights of 1,4,8-Triazacycloundecane
The XLogP value of -0.6 indicates that 1,4,8-Triazacycloundecane is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.1 Ų, 1,4,8-Triazacycloundecane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4,8-Triazacycloundecane has 3 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 1,4,8-Triazacycloundecane?
The CAS number of 1,4,8-Triazacycloundecane is 36815-43-7.
What is the molecular formula of 1,4,8-Triazacycloundecane?
The molecular formula of 1,4,8-Triazacycloundecane is C8H19N3.
What is the molecular weight of 1,4,8-Triazacycloundecane?
The molecular weight of 1,4,8-Triazacycloundecane is 157.16 g/mol.
Where can I buy 1,4,8-Triazacycloundecane?
You can request a quote for 1,4,8-Triazacycloundecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4,8-Triazacycloundecane?
Yes, KEHONG BIO provides custom synthesis services for 1,4,8-Triazacycloundecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.