C228H140N20O4 — CID 164957984
11-(4-phenylphenyl)-12-[4-phenyl-6-(6-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;11-(4-phenylphenyl)-12-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;11-(4-phenylphenyl)-12-[4-phenyl-6-(7-phenyldibenzofuran-3-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;11-(4-phenylphenyl)-12-[4-phenyl-6-(8-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole (PubChem CID 164957984) has the molecular formula C228H140N20O4 and a molecular weight of 3223.76 g/mol. Its IUPAC name is 11-(4-phenylphenyl)-12-[4-phenyl-6-(6-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;11-(4-phenylphenyl)-12-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;11-(4-phenylphenyl)-12-[4-phenyl-6-(7-phenyldibenzofuran-3-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;11-(4-phenylphenyl)-12-[4-phenyl-6-(8-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole.
| Compound Name | 11-(4-phenylphenyl)-12-[4-phenyl-6-(6-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;11-(4-phenylphenyl)-12-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;11-(4-phenylphenyl)-12-[4-phenyl-6-(7-phenyldibenzofuran-3-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;11-(4-phenylphenyl)-12-[4-phenyl-6-(8-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole |
|---|---|
| PubChem CID | 164957984 |
| Molecular Formula | C228H140N20O4 |
| Molecular Weight | 3223.76 g/mol |
| Exact Mass | 3221.14 |
| IUPAC Name | 11-(4-phenylphenyl)-12-[4-phenyl-6-(6-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;11-(4-phenylphenyl)-12-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;11-(4-phenylphenyl)-12-[4-phenyl-6-(7-phenyldibenzofuran-3-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;11-(4-phenylphenyl)-12-[4-phenyl-6-(8-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole |
| SMILES | c1ccc(-c2ccc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6nc(-c7ccccc7)nc(-c7ccc8c(c7)oc7cc(-c9ccccc9)ccc78)n6)c5c43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6nc(-c7ccccc7)nc(-c7ccc8oc9cc(-c%10ccccc%10)ccc9c8c7)n6)c5c43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6nc(-c7ccccc7)nc(-c7ccc8oc9ccc(-c%10ccccc%10)cc9c8c7)n6)c5c43)cc2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6nc(-c7ccccc7)nc(-c7cccc8c7oc7c(-c9ccccc9)cccc78)n6)c5c43)cc2)cc1 |
| InChI | InChI=1S/4C57H35N5O/c1-4-16-36(17-5-1)37-30-32-40(33-31-37)61-49-28-12-10-22-42(49)44-34-35-45-43-23-11-13-29-50(43)62(52(45)51(44)61)57-59-55(39-20-8-3-9-21-39)58-56(60-57)48-27-15-26-47-46-25-14-24-41(53(46)63-54(47)48)38-18-6-2-7-19-38;1-4-14-36(15-5-1)38-24-28-42(29-25-38)61-49-22-12-10-20-43(49)45-30-31-46-44-21-11-13-23-50(44)62(54(46)53(45)61)57-59-55(39-18-8-3-9-19-39)58-56(60-57)41-27-33-52-48(35-41)47-34-40(26-32-51(47)63-52)37-16-6-2-7-17-37;1-4-14-36(15-5-1)38-24-28-42(29-25-38)61-49-22-12-10-20-43(49)46-31-32-47-44-21-11-13-23-50(44)62(54(47)53(46)61)57-59-55(39-18-8-3-9-19-39)58-56(60-57)41-27-33-51-48(34-41)45-30-26-40(35-52(45)63-51)37-16-6-2-7-17-37;1-4-14-36(15-5-1)38-24-28-42(29-25-38)61-49-22-12-10-20-43(49)47-32-33-48-44-21-11-13-23-50(44)62(54(48)53(47)61)57-59-55(39-18-8-3-9-19-39)58-56(60-57)41-27-31-46-45-30-26-40(37-16-6-2-7-17-37)34-51(45)63-52(46)35-41/h4*1-35H |
| InChIKey | BKXQZUFXDLAEMH-UHFFFAOYSA-N |
| XLogP | 58.53 |
| TPSA | 246.68 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 24 |
| Rotatable Bonds | 24 |
| Heavy Atoms | 252 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3223.76 |
| LogP ≤ 5 | 58.53 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 24 |