1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione
TL;DR: 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione (CAS 79713-38-5) is a chemical compound with molecular formula C15H16N2O6 and molecular weight 320.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5,20,21-tetraoxa-12,15-diazatricyclo[15.2.1.17,10]henicosa-1(19),7,9,17-tetraene-11,16-dione
Also Known As: 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione, 3,5-Dioxa-9,12-diaza-1,7(2,5)-difuranacyclotridecaphane-8,13-dione, BRN 5131383
| Molecular Formula | C15H16N2O6 |
|---|---|
| Molecular Weight | 320.10 g/mol |
| LogP | 1.0367 |
| Topological Polar Surface Area | 102.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 320.10083 |
| Heavy Atoms | 23 |
| Complexity | 631.4584 |
Chemical Identifiers
| CAS Number | 79713-38-5 |
|---|---|
| SMILES | C1CNC(=O)C2=CC=C(O2)COCOCC3=CC=C(O3)C(=O)N1 |
Product Overview
1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione (CAS 79713-38-5), with molecular formula C15H16N2O6 and molecular weight 320.10 g/mol. IUPAC: 3,5,20,21-tetraoxa-12,15-diazatricyclo[15.2.1.17,10]henicosa-1(19),7,9,17-tetraene-11,16-dione.
Chemical Property Profile of 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione
Property Insights of 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione
The XLogP value of 1.0367 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione. The TPSA of 102.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione. Following Lipinski's Rule of Five, 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione has 2 hydrogen bond donor(s) and 6 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 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione?
The CAS number of 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione is 79713-38-5.
What is the molecular formula of 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione?
The molecular formula of 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione is C15H16N2O6.
What is the molecular weight of 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione?
The molecular weight of 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione is 320.10 g/mol.
Where can I buy 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione?
You can request a quote for 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,4,6,9-Tetraoxa-12,15-diazadifuro(2,1,5-a,q:2,1,5-h,i)cycloheptadecane-11,16-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.