C103H65N9O3 — CID 165090138
2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-1-ylphenyl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylphenyl)-4,6-diphenyl-1,3,5-triazine (PubChem CID 165090138) has the molecular formula C103H65N9O3 and a molecular weight of 1476.71 g/mol. Its IUPAC name is 2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-1-ylphenyl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylphenyl)-4,6-diphenyl-1,3,5-triazine.
| Compound Name | 2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-1-ylphenyl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylphenyl)-4,6-diphenyl-1,3,5-triazine |
|---|---|
| PubChem CID | 165090138 |
| Molecular Formula | C103H65N9O3 |
| Molecular Weight | 1476.71 g/mol |
| Exact Mass | 1475.52 |
| IUPAC Name | 2-(4-dibenzofuran-1-ylnaphthalen-1-yl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-1-ylphenyl)-4,6-diphenyl-1,3,5-triazine;2-(4-dibenzofuran-4-ylphenyl)-4,6-diphenyl-1,3,5-triazine |
| SMILES | c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5c4oc4ccccc45)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5oc6ccccc6c45)c4ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc5oc6ccccc6c45)cc3)n2)cc1 |
| InChI | InChI=1S/C37H23N3O.2C33H21N3O/c1-3-12-24(13-4-1)35-38-36(25-14-5-2-6-15-25)40-37(39-35)30-23-22-28(26-16-7-8-17-27(26)30)29-19-11-21-33-34(29)31-18-9-10-20-32(31)41-33;1-3-10-23(11-4-1)31-34-32(24-12-5-2-6-13-24)36-33(35-31)25-20-18-22(19-21-25)26-15-9-16-28-27-14-7-8-17-29(27)37-30(26)28;1-3-10-23(11-4-1)31-34-32(24-12-5-2-6-13-24)36-33(35-31)25-20-18-22(19-21-25)26-15-9-17-29-30(26)27-14-7-8-16-28(27)37-29/h1-23H;2*1-21H |
| InChIKey | WOCKYFIMFHAEHC-UHFFFAOYSA-N |
| XLogP | 26.47 |
| TPSA | 155.43 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 115 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1476.71 |
| LogP ≤ 5 | 26.47 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |