![14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione structure](/static/products/1770/177082-76-7.webp)
14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione
TL;DR: 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione (CAS 177082-76-7) is a chemical compound with molecular formula C22H15FN4O3 and molecular weight 402.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14-fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione
Also Known As: 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione, 9-Fluoro-2,4-dimethyl-5-phenylbenzo[b]pyrimido[4,5-h][1,6]naphthyridine-1,3,6(2H,4H,5H)-trione
| Molecular Formula | C22H15FN4O3 |
|---|---|
| Molecular Weight | 402.11 g/mol |
| LogP | 2.2286 |
| Topological Polar Surface Area | 78.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 402.11282 |
| Heavy Atoms | 30 |
| Complexity | 1681.5879 |
Chemical Identifiers
| CAS Number | 177082-76-7 |
|---|---|
| SMILES | CN1C2=C(C3=C(C=C4C=C(C=CC4=N3)F)C(=O)N2C5=CC=CC=C5)C(=O)N(C1=O)C |
Product Overview
14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione (CAS 177082-76-7), with molecular formula C22H15FN4O3 and molecular weight 402.11 g/mol. IUPAC: 14-fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione.
Chemical Property Profile of 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione
Property Insights of 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione
The XLogP value of 2.2286 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione. The TPSA of 78.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione. Following Lipinski's Rule of Five, 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione has 0 hydrogen bond donor(s) and 4 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 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione?
The CAS number of 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione is 177082-76-7.
What is the molecular formula of 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione?
The molecular formula of 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione is C22H15FN4O3.
What is the molecular weight of 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione?
The molecular weight of 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione is 402.11 g/mol.
Where can I buy 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione?
You can request a quote for 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione?
Yes, KEHONG BIO provides custom synthesis services for 14-Fluoro-4,6-dimethyl-8-phenyl-4,6,8,18-tetrazatetracyclo[8.8.0.02,7.012,17]octadeca-1(10),2(7),11,13,15,17-hexaene-3,5,9-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.