C51H32N4O — CID 146335946
4-phenyl-9-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]carbazole (PubChem CID 146335946) has the molecular formula C51H32N4O and a molecular weight of 716.84 g/mol. Its IUPAC name is 4-phenyl-9-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]carbazole.
| Compound Name | 4-phenyl-9-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]carbazole |
|---|---|
| PubChem CID | 146335946 |
| Molecular Formula | C51H32N4O |
| Molecular Weight | 716.84 g/mol |
| Exact Mass | 716.26 |
| IUPAC Name | 4-phenyl-9-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]dibenzofuran-4-yl]carbazole |
| SMILES | c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc5c(c4)oc4c(-n6c7ccccc7c7c(-c8ccccc8)cccc76)cccc45)n3)cc2)cc1 |
| InChI | InChI=1S/C51H32N4O/c1-4-14-33(15-5-1)34-26-28-37(29-27-34)50-52-49(36-18-8-3-9-19-36)53-51(54-50)38-30-31-40-41-22-13-25-45(48(41)56-46(40)32-38)55-43-23-11-10-20-42(43)47-39(21-12-24-44(47)55)35-16-6-2-7-17-35/h1-32H |
| InChIKey | APYADTXRUVFSOC-UHFFFAOYSA-N |
| XLogP | 13.20 |
| TPSA | 56.74 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 56 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 716.84 |
| LogP ≤ 5 | 13.20 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 5 |