About 10-[2-(4-fluorophenyl)-4-phenylquinolin-8-yl]phenoxazine
10-[2-(4-fluorophenyl)-4-phenylquinolin-8-yl]phenoxazine (PubChem CID 176668808) has the molecular formula C33H21FN2O
and a molecular weight of 480.54 g/mol. Its IUPAC name is 10-[2-(4-fluorophenyl)-4-phenylquinolin-8-yl]phenoxazine.
Molecular Properties
| Compound Name | 10-[2-(4-fluorophenyl)-4-phenylquinolin-8-yl]phenoxazine |
| PubChem CID | 176668808 |
| Molecular Formula | C33H21FN2O |
| Molecular Weight | 480.54 g/mol |
| Exact Mass | 480.16 |
| IUPAC Name | 10-[2-(4-fluorophenyl)-4-phenylquinolin-8-yl]phenoxazine |
| SMILES | Fc1ccc(-c2cc(-c3ccccc3)c3cccc(N4c5ccccc5Oc5ccccc54)c3n2)cc1 |
| InChI | InChI=1S/C33H21FN2O/c34-24-19-17-23(18-20-24)27-21-26(22-9-2-1-3-10-22)25-11-8-14-30(33(25)35-27)36-28-12-4-6-15-31(28)37-32-16-7-5-13-29(32)36/h1-21H |
| InChIKey | PUNJCJMLHZCEAE-UHFFFAOYSA-N |
| XLogP | 9.28 |
| TPSA | 25.36 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 37 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 480.54 |
| LogP ≤ 5 | 9.28 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 10-[2-(4-fluorophenyl)-4-phenylquinolin-8-yl]phenoxazine?
The IUPAC name of 10-[2-(4-fluorophenyl)-4-phenylquinolin-8-yl]phenoxazine (CID 176668808) is 10-[2-(4-fluorophenyl)-4-phenylquinolin-8-yl]phenoxazine.
What is the SMILES notation for 10-[2-(4-fluorophenyl)-4-phenylquinolin-8-yl]phenoxazine?
The canonical SMILES for 10-[2-(4-fluorophenyl)-4-phenylquinolin-8-yl]phenoxazine is Fc1ccc(-c2cc(-c3ccccc3)c3cccc(N4c5ccccc5Oc5ccccc54)c3n2)cc1.
What is the InChIKey of 10-[2-(4-fluorophenyl)-4-phenylquinolin-8-yl]phenoxazine?
The InChIKey is PUNJCJMLHZCEAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H21FN2O/c34-24-19-17-23(18-20-24)27-21-26(22-9-2-1-3-10-22)25-11-8-14-30(33(25)35-27)36-28-12-4-6-15-31(28)37-32-16-7-5-13-29(32)36/h1-21H.
What are the key properties of 10-[2-(4-fluorophenyl)-4-phenylquinolin-8-yl]phenoxazine?
10-[2-(4-fluorophenyl)-4-phenylquinolin-8-yl]phenoxazine has a molecular weight of 480.54 g/mol, XLogP of 9.28, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[2-(4-fluorophenyl)-4-phenylquinolin-8-yl]phenoxazine is sourced from PubChem (CID 176668808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).