1,4,10-Trioxa-7,13-diazacyclopentadecane
TL;DR: 1,4,10-Trioxa-7,13-diazacyclopentadecane (CAS 31249-95-3) is a chemical compound with molecular formula C10H22N2O3 and molecular weight 218.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,10-trioxa-7,13-diazacyclopentadecane
Also Known As: 1,4,10-Trioxa-7,13-diazacyclopentadecane, cryptand 21, Kryptofix 21, Diaza-15-crown-5, 4,10-Diaza-15-crown 5-Ether
| Molecular Formula | C10H22N2O3 |
|---|---|
| Molecular Weight | 218.16 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 218.16304 |
| Heavy Atoms | 15 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 31249-95-3 |
|---|---|
| SMILES | C1COCCNCCOCCOCCN1 |
| InChIKey | STHIZMRUXPMSCW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4,10-Trioxa-7,13-diazacyclopentadecane (CAS 31249-95-3), with molecular formula C10H22N2O3 and molecular weight 218.16 g/mol. IUPAC: 1,4,10-trioxa-7,13-diazacyclopentadecane.
Chemical Property Profile of 1,4,10-Trioxa-7,13-diazacyclopentadecane
Property Insights of 1,4,10-Trioxa-7,13-diazacyclopentadecane
The XLogP value of -1.3 indicates that 1,4,10-Trioxa-7,13-diazacyclopentadecane is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 51.8 Ų, 1,4,10-Trioxa-7,13-diazacyclopentadecane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4,10-Trioxa-7,13-diazacyclopentadecane has 2 hydrogen bond donor(s) and 5 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 1,4,10-Trioxa-7,13-diazacyclopentadecane?
The CAS number of 1,4,10-Trioxa-7,13-diazacyclopentadecane is 31249-95-3.
What is the molecular formula of 1,4,10-Trioxa-7,13-diazacyclopentadecane?
The molecular formula of 1,4,10-Trioxa-7,13-diazacyclopentadecane is C10H22N2O3.
What is the molecular weight of 1,4,10-Trioxa-7,13-diazacyclopentadecane?
The molecular weight of 1,4,10-Trioxa-7,13-diazacyclopentadecane is 218.16 g/mol.
Where can I buy 1,4,10-Trioxa-7,13-diazacyclopentadecane?
You can request a quote for 1,4,10-Trioxa-7,13-diazacyclopentadecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4,10-Trioxa-7,13-diazacyclopentadecane?
Yes, KEHONG BIO provides custom synthesis services for 1,4,10-Trioxa-7,13-diazacyclopentadecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.