C167H107N15 — CID 158632297
5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-3-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-triphenylen-2-ylindolo[2,3-b]carbazole (PubChem CID 158632297) has the molecular formula C167H107N15 and a molecular weight of 2323.80 g/mol. Its IUPAC name is 5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-3-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-triphenylen-2-ylindolo[2,3-b]carbazole.
| Compound Name | 5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-3-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-triphenylen-2-ylindolo[2,3-b]carbazole |
|---|---|
| PubChem CID | 158632297 |
| Molecular Formula | C167H107N15 |
| Molecular Weight | 2323.80 g/mol |
| Exact Mass | 2321.88 |
| IUPAC Name | 5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;5-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;7-phenyl-5-(6-phenyl-3-pyridinyl)indolo[2,3-b]carbazole;7-phenyl-5-triphenylen-2-ylindolo[2,3-b]carbazole |
| SMILES | c1ccc(-c2ccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccccc6)c5cc43)cn2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c7ccccc7n(-c7ccccc7)c6cc54)cc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc6c7ccccc7n(-c7ccccc7)c6cc54)c3)n2)cc1.c1ccc(-n2c3ccccc3c3cc4c5ccccc5n(-c5ccc6c7ccccc7c7ccccc7c6c5)c4cc32)cc1 |
| InChI | InChI=1S/2C45H29N5.C42H26N2.C35H23N3/c1-4-15-30(16-5-1)43-46-44(31-17-6-2-7-18-31)48-45(47-43)32-19-14-22-34(27-32)50-40-26-13-11-24-36(40)38-28-37-35-23-10-12-25-39(35)49(41(37)29-42(38)50)33-20-8-3-9-21-33;1-4-14-30(15-5-1)43-46-44(31-16-6-2-7-17-31)48-45(47-43)32-24-26-34(27-25-32)50-40-23-13-11-21-36(40)38-28-37-35-20-10-12-22-39(35)49(41(37)29-42(38)50)33-18-8-3-9-19-33;1-2-12-27(13-3-1)43-39-20-10-8-18-34(39)37-25-38-35-19-9-11-21-40(35)44(42(38)26-41(37)43)28-22-23-33-31-16-5-4-14-29(31)30-15-6-7-17-32(30)36(33)24-28;1-3-11-24(12-4-1)31-20-19-26(23-36-31)38-33-18-10-8-16-28(33)30-21-29-27-15-7-9-17-32(27)37(34(29)22-35(30)38)25-13-5-2-6-14-25/h2*1-29H;1-26H;1-23H |
| InChIKey | HZIQLNHUZNRNND-UHFFFAOYSA-N |
| XLogP | 42.42 |
| TPSA | 129.67 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 15 |
| Heavy Atoms | 182 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2323.80 |
| LogP ≤ 5 | 42.42 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 15 |
| Structural Alerts | {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'} |
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