C102H66N6 — CID 164983675
3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole (PubChem CID 164983675) has the molecular formula C102H66N6 and a molecular weight of 1375.69 g/mol. Its IUPAC name is 3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole.
| Compound Name | 3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole |
|---|---|
| PubChem CID | 164983675 |
| Molecular Formula | C102H66N6 |
| Molecular Weight | 1375.69 g/mol |
| Exact Mass | 1374.53 |
| IUPAC Name | 3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole |
| SMILES | c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6ccccc56)ccc43)c2)cc1.c1ccc(-c2cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6ccccc56)ccc43)cc(-c3ccccc3)n2)cc1 |
| InChI | InChI=1S/2C51H33N3/c1-3-15-35(16-4-1)45-32-39(33-46(52-45)36-17-5-2-6-18-36)53-48-23-11-9-21-41(48)43-30-37(26-28-50(43)53)38-27-29-51-44(31-38)42-22-10-12-24-49(42)54(51)47-25-13-19-34-14-7-8-20-40(34)47;1-3-14-34(15-4-1)39-32-45(36-17-5-2-6-18-36)52-51(33-39)54-48-24-12-10-22-42(48)44-31-38(27-29-50(44)54)37-26-28-49-43(30-37)41-21-9-11-23-47(41)53(49)46-25-13-19-35-16-7-8-20-40(35)46/h2*1-33H |
| InChIKey | FVSBSLZGDSLKGA-UHFFFAOYSA-N |
| XLogP | 26.86 |
| TPSA | 45.50 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Heavy Atoms | 108 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1375.69 |
| LogP ≤ 5 | 26.86 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |