Phenylacetylbenzo-15-crown-5
TL;DR: Phenylacetylbenzo-15-crown-5 (CAS 79997-19-6) is a chemical compound with molecular formula C22H26O6 and molecular weight 386.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-yl)-2-phenylethanone
Also Known As: Phenylacetylbenzo-15-crown-5, Ethanone, 1-(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)-2-phenyl-, AQ-917/40204565, 1-(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)-2-phenylethanone, 1-(2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-yl)-2-phenylethanone
| Molecular Formula | C22H26O6 |
|---|---|
| Molecular Weight | 386.17 g/mol |
| LogP | 2.933 |
| Topological Polar Surface Area | 63.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 386.17294 |
| Heavy Atoms | 28 |
| Complexity | 731.06177 |
Chemical Identifiers
| CAS Number | 79997-19-6 |
|---|---|
| SMILES | C1COCCOC2=C(C=C(C=C2)C(=O)CC3=CC=CC=C3)OCCOCCO1 |
Product Overview
Phenylacetylbenzo-15-crown-5 (CAS 79997-19-6), with molecular formula C22H26O6 and molecular weight 386.17 g/mol. IUPAC: 1-(2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-yl)-2-phenylethanone.
Chemical Property Profile of Phenylacetylbenzo-15-crown-5
Property Insights of Phenylacetylbenzo-15-crown-5
The XLogP value of 2.933 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenylacetylbenzo-15-crown-5. The TPSA of 63.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenylacetylbenzo-15-crown-5. Following Lipinski's Rule of Five, Phenylacetylbenzo-15-crown-5 has 0 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 Phenylacetylbenzo-15-crown-5?
The CAS number of Phenylacetylbenzo-15-crown-5 is 79997-19-6.
What is the molecular formula of Phenylacetylbenzo-15-crown-5?
The molecular formula of Phenylacetylbenzo-15-crown-5 is C22H26O6.
What is the molecular weight of Phenylacetylbenzo-15-crown-5?
The molecular weight of Phenylacetylbenzo-15-crown-5 is 386.17 g/mol.
Where can I buy Phenylacetylbenzo-15-crown-5?
You can request a quote for Phenylacetylbenzo-15-crown-5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenylacetylbenzo-15-crown-5?
Yes, KEHONG BIO provides custom synthesis services for Phenylacetylbenzo-15-crown-5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.