C132H83N9O4 — CID 165075040
2-dibenzofuran-3-yl-4-(3-naphtho[2,1-b][1]benzofuran-1-ylphenyl)-6-phenyl-1,3,5-triazine;2-(9,9-dimethylfluoren-2-yl)-4-(3-naphtho[2,1-b][1]benzofuran-2-ylphenyl)-6-phenyl-1,3,5-triazine;2-(3-naphtho[2,1-b][1]benzofuran-3-ylphenyl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine (PubChem CID 165075040) has the molecular formula C132H83N9O4 and a molecular weight of 1859.17 g/mol. Its IUPAC name is 2-dibenzofuran-3-yl-4-(3-naphtho[2,1-b][1]benzofuran-1-ylphenyl)-6-phenyl-1,3,5-triazine;2-(9,9-dimethylfluoren-2-yl)-4-(3-naphtho[2,1-b][1]benzofuran-2-ylphenyl)-6-phenyl-1,3,5-triazine;2-(3-naphtho[2,1-b][1]benzofuran-3-ylphenyl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine.
| Compound Name | 2-dibenzofuran-3-yl-4-(3-naphtho[2,1-b][1]benzofuran-1-ylphenyl)-6-phenyl-1,3,5-triazine;2-(9,9-dimethylfluoren-2-yl)-4-(3-naphtho[2,1-b][1]benzofuran-2-ylphenyl)-6-phenyl-1,3,5-triazine;2-(3-naphtho[2,1-b][1]benzofuran-3-ylphenyl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine |
|---|---|
| PubChem CID | 165075040 |
| Molecular Formula | C132H83N9O4 |
| Molecular Weight | 1859.17 g/mol |
| Exact Mass | 1857.66 |
| IUPAC Name | 2-dibenzofuran-3-yl-4-(3-naphtho[2,1-b][1]benzofuran-1-ylphenyl)-6-phenyl-1,3,5-triazine;2-(9,9-dimethylfluoren-2-yl)-4-(3-naphtho[2,1-b][1]benzofuran-2-ylphenyl)-6-phenyl-1,3,5-triazine;2-(3-naphtho[2,1-b][1]benzofuran-3-ylphenyl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine |
| SMILES | CC1(C)c2ccccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccc6ccc7oc8ccccc8c7c6c5)c4)n3)cc21.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccc6c(ccc7oc8ccccc8c76)c5)c4)n3)cc2)cc1.c1ccc(-c2nc(-c3cccc(-c4cccc5ccc6oc7ccccc7c6c45)c3)nc(-c3ccc4c(c3)oc3ccccc34)n2)cc1 |
| InChI | InChI=1S/C46H31N3O.C43H25N3O2.C43H27N3O/c1-46(2)38-17-8-6-15-34(38)35-23-21-33(27-39(35)46)45-48-43(29-11-4-3-5-12-29)47-44(49-45)32-14-10-13-30(25-32)31-20-19-28-22-24-41-42(37(28)26-31)36-16-7-9-18-40(36)50-41;1-2-10-27(11-3-1)41-44-42(46-43(45-41)30-20-22-33-32-15-4-6-18-35(32)48-38(33)25-30)29-14-8-13-28(24-29)31-17-9-12-26-21-23-37-40(39(26)31)34-16-5-7-19-36(34)47-37;1-3-10-28(11-4-1)29-18-20-31(21-19-29)42-44-41(30-12-5-2-6-13-30)45-43(46-42)35-15-9-14-32(27-35)33-22-24-36-34(26-33)23-25-39-40(36)37-16-7-8-17-38(37)47-39/h3-27H,1-2H3;1-25H;1-27H |
| InChIKey | UDYLKWYVZHTMIW-UHFFFAOYSA-N |
| XLogP | 34.65 |
| TPSA | 168.57 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 13 |
| Rotatable Bonds | 13 |
| Heavy Atoms | 145 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1859.17 |
| LogP ≤ 5 | 34.65 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 13 |