C204H132N12O4 — CID 161265664
2,4-diphenyl-6-[2-[8-[3-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[8-[4-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[8-[4-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[4-[8-[4-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine (PubChem CID 161265664) has the molecular formula C204H132N12O4 and a molecular weight of 2815.38 g/mol. Its IUPAC name is 2,4-diphenyl-6-[2-[8-[3-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[8-[4-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[8-[4-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[4-[8-[4-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine.
| Compound Name | 2,4-diphenyl-6-[2-[8-[3-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[8-[4-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[8-[4-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[4-[8-[4-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine |
|---|---|
| PubChem CID | 161265664 |
| Molecular Formula | C204H132N12O4 |
| Molecular Weight | 2815.38 g/mol |
| Exact Mass | 2813.05 |
| IUPAC Name | 2,4-diphenyl-6-[2-[8-[3-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[8-[4-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[3-[8-[4-(4-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine;2,4-diphenyl-6-[4-[8-[4-(3-phenylphenyl)phenyl]dibenzofuran-1-yl]phenyl]-1,3,5-triazine |
| SMILES | c1ccc(-c2ccc(-c3ccc(-c4ccc5oc6cccc(-c7cccc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c7)c6c5c4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3cccc(-c4ccc5oc6cccc(-c7ccccc7-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)c6c5c4)c3)cc2)cc1.c1ccc(-c2cccc(-c3ccc(-c4ccc5oc6cccc(-c7ccc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)cc7)c6c5c4)cc3)c2)cc1.c1ccc(-c2cccc(-c3ccc(-c4ccc5oc6cccc(-c7cccc(-c8nc(-c9ccccc9)nc(-c9ccccc9)n8)c7)c6c5c4)cc3)c2)cc1 |
| InChI | InChI=1S/4C51H33N3O/c1-4-13-34(14-5-1)39-19-10-20-40(31-39)35-25-27-36(28-26-35)41-29-30-46-45(33-41)48-44(23-12-24-47(48)55-46)42-21-11-22-43(32-42)51-53-49(37-15-6-2-7-16-37)52-50(54-51)38-17-8-3-9-18-38;1-4-12-34(13-5-1)41-18-10-19-42(32-41)35-22-24-36(25-23-35)43-30-31-46-45(33-43)48-44(20-11-21-47(48)55-46)37-26-28-40(29-27-37)51-53-49(38-14-6-2-7-15-38)52-50(54-51)39-16-8-3-9-17-39;1-4-12-34(13-5-1)35-22-24-36(25-23-35)37-26-28-38(29-27-37)41-30-31-46-45(33-41)48-44(20-11-21-47(48)55-46)42-18-10-19-43(32-42)51-53-49(39-14-6-2-7-15-39)52-50(54-51)40-16-8-3-9-17-40;1-4-14-34(15-5-1)35-26-28-36(29-27-35)39-20-12-21-40(32-39)41-30-31-46-45(33-41)48-43(24-13-25-47(48)55-46)42-22-10-11-23-44(42)51-53-49(37-16-6-2-7-17-37)52-50(54-51)38-18-8-3-9-19-38/h4*1-33H |
| InChIKey | VDDLNCYMWXGCDR-UHFFFAOYSA-N |
| XLogP | 53.76 |
| TPSA | 207.24 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 28 |
| Heavy Atoms | 220 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2815.38 |
| LogP ≤ 5 | 53.76 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 16 |