C249H157N23O4S — CID 158866794
2-dibenzofuran-3-yl-4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-2-yl-4-(4-naphthalen-2-ylphenyl)-6-phenyl-1,3,5-triazine;3-[2-(3-dibenzofuran-3-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]benzonitrile;9-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;2,4-diphenyl-6-[3-[6-(4-phenylphenyl)dibenzothiophen-4-yl]phenyl]-1,3,5-triazine;3-phenyl-9-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole (PubChem CID 158866794) has the molecular formula C249H157N23O4S and a molecular weight of 3567.22 g/mol. Its IUPAC name is 2-dibenzofuran-3-yl-4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-2-yl-4-(4-naphthalen-2-ylphenyl)-6-phenyl-1,3,5-triazine;3-[2-(3-dibenzofuran-3-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]benzonitrile;9-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;2,4-diphenyl-6-[3-[6-(4-phenylphenyl)dibenzothiophen-4-yl]phenyl]-1,3,5-triazine;3-phenyl-9-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole.
| Compound Name | 2-dibenzofuran-3-yl-4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-2-yl-4-(4-naphthalen-2-ylphenyl)-6-phenyl-1,3,5-triazine;3-[2-(3-dibenzofuran-3-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]benzonitrile;9-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;2,4-diphenyl-6-[3-[6-(4-phenylphenyl)dibenzothiophen-4-yl]phenyl]-1,3,5-triazine;3-phenyl-9-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole |
|---|---|
| PubChem CID | 158866794 |
| Molecular Formula | C249H157N23O4S |
| Molecular Weight | 3567.22 g/mol |
| Exact Mass | 3564.25 |
| IUPAC Name | 2-dibenzofuran-3-yl-4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6-phenyl-1,3,5-triazine;2-dibenzofuran-2-yl-4-(4-naphthalen-2-ylphenyl)-6-phenyl-1,3,5-triazine;3-[2-(3-dibenzofuran-3-ylphenyl)-6-(4-phenylphenyl)pyrimidin-4-yl]benzonitrile;9-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole;2,4-diphenyl-6-[3-[6-(4-phenylphenyl)dibenzothiophen-4-yl]phenyl]-1,3,5-triazine;3-phenyl-9-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole |
| SMILES | N#Cc1cccc(-c2cc(-c3ccc(-c4ccccc4)cc3)nc(-c3cccc(-c4ccc5c(c4)oc4ccccc45)c3)n2)c1.c1ccc(-c2ccc(-c3cccc4c3sc3c(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)c5)cccc34)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc(-n5c6ccccc6c6cc(-c7ccccc7)ccc65)cc4)n3)cc2)cc1.c1ccc(-c2nc(-c3ccc(-c4ccc5ccccc5c4)cc3)nc(-c3ccc4oc5ccccc5c4c3)n2)cc1.c1ccc(-c2nc(-c3cccc(-n4c5ccccc5c5ccccc54)c3)nc(-c3ccc4c(c3)oc3ccccc34)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5ccc6c(c5)oc5ccccc56)n4)c3)n2)cc1 |
| InChI | InChI=1S/C45H30N4.C45H29N3S.C42H26N6O.C41H25N3O.C39H24N4O.C37H23N3O/c1-4-12-31(13-5-1)33-20-22-35(23-21-33)44-46-43(34-16-8-3-9-17-34)47-45(48-44)36-24-27-38(28-25-36)49-41-19-11-10-18-39(41)40-30-37(26-29-42(40)49)32-14-6-2-7-15-32;1-4-13-30(14-5-1)31-25-27-32(28-26-31)37-21-11-23-39-40-24-12-22-38(42(40)49-41(37)39)35-19-10-20-36(29-35)45-47-43(33-15-6-2-7-16-33)46-44(48-45)34-17-8-3-9-18-34;1-4-13-27(14-5-1)37-43-38(28-15-6-2-7-16-28)45-40(44-37)30-19-12-20-31(25-30)41-46-39(29-17-8-3-9-18-29)47-42(48-41)32-23-24-34-33-21-10-11-22-35(33)49-36(34)26-32;42-26-27-8-6-12-33(22-27)38-25-37(30-18-16-29(17-19-30)28-9-2-1-3-10-28)43-41(44-38)34-13-7-11-31(23-34)32-20-21-36-35-14-4-5-15-39(35)45-40(36)24-32;1-2-11-25(12-3-1)37-40-38(42-39(41-37)27-21-22-32-31-17-6-9-20-35(31)44-36(32)24-27)26-13-10-14-28(23-26)43-33-18-7-4-15-29(33)30-16-5-8-19-34(30)43;1-2-9-26(10-3-1)35-38-36(27-17-14-25(15-18-27)29-19-16-24-8-4-5-11-28(24)22-29)40-37(39-35)30-20-21-34-32(23-30)31-12-6-7-13-33(31)41-34/h1-30H;1-29H;1-26H;1-25H;1-24H;1-23H |
| InChIKey | JBIKFKCGEJBDTB-UHFFFAOYSA-N |
| XLogP | 63.55 |
| TPSA | 344.01 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 28 |
| Rotatable Bonds | 31 |
| Heavy Atoms | 277 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3567.22 |
| LogP ≤ 5 | 63.55 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 28 |