C252H156N20O4 — CID 165100259
1-phenyl-11-(3-phenylphenyl)-12-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;1-phenyl-12-(3-phenylphenyl)-11-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;4-phenyl-11-(3-phenylphenyl)-12-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;4-phenyl-12-(3-phenylphenyl)-11-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole (PubChem CID 165100259) has the molecular formula C252H156N20O4 and a molecular weight of 3528.16 g/mol. Its IUPAC name is 1-phenyl-11-(3-phenylphenyl)-12-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;1-phenyl-12-(3-phenylphenyl)-11-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;4-phenyl-11-(3-phenylphenyl)-12-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;4-phenyl-12-(3-phenylphenyl)-11-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole.
| Compound Name | 1-phenyl-11-(3-phenylphenyl)-12-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;1-phenyl-12-(3-phenylphenyl)-11-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;4-phenyl-11-(3-phenylphenyl)-12-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;4-phenyl-12-(3-phenylphenyl)-11-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole |
|---|---|
| PubChem CID | 165100259 |
| Molecular Formula | C252H156N20O4 |
| Molecular Weight | 3528.16 g/mol |
| Exact Mass | 3525.26 |
| IUPAC Name | 1-phenyl-11-(3-phenylphenyl)-12-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;1-phenyl-12-(3-phenylphenyl)-11-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;4-phenyl-11-(3-phenylphenyl)-12-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;4-phenyl-12-(3-phenylphenyl)-11-[4-phenyl-6-(9-phenyldibenzofuran-1-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole |
| SMILES | c1ccc(-c2cccc(-n3c4c(-c5ccccc5)cccc4c4ccc5c6ccccc6n(-c6nc(-c7ccccc7)nc(-c7cccc8oc9cccc(-c%10ccccc%10)c9c78)n6)c5c43)c2)cc1.c1ccc(-c2cccc(-n3c4cccc(-c5ccccc5)c4c4ccc5c6ccccc6n(-c6nc(-c7ccccc7)nc(-c7cccc8oc9cccc(-c%10ccccc%10)c9c78)n6)c5c43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4ccc5c6c(-c7ccccc7)cccc6n(-c6nc(-c7ccccc7)nc(-c7cccc8oc9cccc(-c%10ccccc%10)c9c78)n6)c5c43)c2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4ccc5c6cccc(-c7ccccc7)c6n(-c6nc(-c7ccccc7)nc(-c7cccc8oc9cccc(-c%10ccccc%10)c9c78)n6)c5c43)c2)cc1 |
| InChI | InChI=1S/4C63H39N5O/c1-5-19-40(20-6-1)44-27-15-28-45(39-44)67-58-47(42-23-9-3-10-24-42)31-16-32-49(58)51-38-37-50-48-29-13-14-34-53(48)68(60(50)59(51)67)63-65-61(43-25-11-4-12-26-43)64-62(66-63)52-33-18-36-55-57(52)56-46(30-17-35-54(56)69-55)41-21-7-2-8-22-41;1-5-19-40(20-6-1)44-27-15-28-45(39-44)67-53-34-14-13-29-48(53)50-37-38-51-49-32-16-31-47(42-23-9-3-10-24-42)58(49)68(60(51)59(50)67)63-65-61(43-25-11-4-12-26-43)64-62(66-63)52-33-18-36-55-57(52)56-46(30-17-35-54(56)69-55)41-21-7-2-8-22-41;1-5-19-40(20-6-1)44-27-15-28-45(39-44)67-53-34-16-30-46(41-21-7-2-8-22-41)56(53)50-38-37-49-48-29-13-14-33-52(48)68(59(49)60(50)67)63-65-61(43-25-11-4-12-26-43)64-62(66-63)51-32-18-36-55-58(51)57-47(31-17-35-54(57)69-55)42-23-9-3-10-24-42;1-5-19-40(20-6-1)44-27-15-28-45(39-44)67-52-33-14-13-29-48(52)49-37-38-50-56-46(41-21-7-2-8-22-41)30-16-34-53(56)68(60(50)59(49)67)63-65-61(43-25-11-4-12-26-43)64-62(66-63)51-32-18-36-55-58(51)57-47(31-17-35-54(57)69-55)42-23-9-3-10-24-42/h4*1-39H |
| InChIKey | YEZFYSPTIXABQV-UHFFFAOYSA-N |
| XLogP | 65.20 |
| TPSA | 246.68 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 24 |
| Rotatable Bonds | 28 |
| Heavy Atoms | 276 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3528.16 |
| LogP ≤ 5 | 65.20 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 24 |