18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione
TL;DR: 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione (CAS 76461-91-1) is a chemical compound with molecular formula C19H26O8 and molecular weight 382.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
18-phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione
Also Known As: 18-phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione
| Molecular Formula | C19H26O8 |
|---|---|
| Molecular Weight | 382.16 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 89.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 382.16278 |
| Heavy Atoms | 27 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 76461-91-1 |
|---|---|
| SMILES | C1COCCOCCOC(=O)C(C(=O)OCCOCCO1)C2=CC=CC=C2 |
| InChIKey | CUMQTPGSWVDOBC-UHFFFAOYSA-N |
Product Overview
18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione (CAS 76461-91-1), with molecular formula C19H26O8 and molecular weight 382.16 g/mol. IUPAC: 18-phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione.
Chemical Property Profile of 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione
Property Insights of 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione. The TPSA of 89.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione. Following Lipinski's Rule of Five, 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione has 0 hydrogen bond donor(s) and 8 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 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione?
The CAS number of 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione is 76461-91-1.
What is the molecular formula of 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione?
The molecular formula of 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione is C19H26O8.
What is the molecular weight of 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione?
The molecular weight of 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione is 382.16 g/mol.
Where can I buy 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione?
You can request a quote for 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione?
Yes, KEHONG BIO provides custom synthesis services for 18-Phenyl-1,4,7,10,13,16-hexaoxacyclononadecane-17,19-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.