C316H208N18 — CID 167712900
3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(2,6-diphenyl-4-pyridinyl)carbazole;3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4,6-diphenyl-2-pyridinyl)carbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole (PubChem CID 167712900) has the molecular formula C316H208N18 and a molecular weight of 4257.27 g/mol. Its IUPAC name is 3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(2,6-diphenyl-4-pyridinyl)carbazole;3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4,6-diphenyl-2-pyridinyl)carbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole.
| Compound Name | 3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(2,6-diphenyl-4-pyridinyl)carbazole;3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4,6-diphenyl-2-pyridinyl)carbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole |
|---|---|
| PubChem CID | 167712900 |
| Molecular Formula | C316H208N18 |
| Molecular Weight | 4257.27 g/mol |
| Exact Mass | 4253.68 |
| IUPAC Name | 3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(2,6-diphenyl-4-pyridinyl)carbazole;3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4,6-diphenyl-2-pyridinyl)carbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-naphthalen-1-ylcarbazole;3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(4,6-diphenyl-2-pyridinyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole |
| SMILES | c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)ccc43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cc(-c6ccccc6)nc(-c6ccccc6)c5)ccc43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6ccccc56)ccc43)c2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)c2)cc1.c1ccc(-c2cc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)cc(-c3ccccc3)n2)cc1.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)ccc43)cc2)cc1 |
| InChI | InChI=1S/2C59H39N3.C53H35N3.C51H33N3.2C47H31N3/c1-5-17-40(18-6-1)46-33-47(41-19-7-2-8-20-41)35-49(34-46)61-55-27-15-13-25-50(55)52-36-44(29-31-57(52)61)45-30-32-58-53(37-45)51-26-14-16-28-56(51)62(58)59-39-48(42-21-9-3-10-22-42)38-54(60-59)43-23-11-4-12-24-43;1-5-17-40(18-6-1)46-33-47(41-19-7-2-8-20-41)35-48(34-46)61-56-27-15-13-25-50(56)52-36-44(29-31-58(52)61)45-30-32-59-53(37-45)51-26-14-16-28-57(51)62(59)49-38-54(42-21-9-3-10-22-42)60-55(39-49)43-23-11-4-12-24-43;1-4-14-36(15-5-1)38-24-28-43(29-25-38)55-49-22-12-10-20-44(49)46-32-40(26-30-51(46)55)41-27-31-52-47(33-41)45-21-11-13-23-50(45)56(52)53-35-42(37-16-6-2-7-17-37)34-48(54-53)39-18-8-3-9-19-39;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;1-4-14-32(15-5-1)36-30-42(33-16-6-2-7-17-33)48-47(31-36)50-44-23-13-11-21-39(44)41-29-35(25-27-46(41)50)34-24-26-45-40(28-34)38-20-10-12-22-43(38)49(45)37-18-8-3-9-19-37;1-4-14-32(15-5-1)42-30-37(31-43(48-42)33-16-6-2-7-17-33)50-45-23-13-11-21-39(45)41-29-35(25-27-47(41)50)34-24-26-46-40(28-34)38-20-10-12-22-44(38)49(46)36-18-8-3-9-19-36/h2*1-39H;1-35H;1-33H;2*1-31H |
| InChIKey | YSKXWJVDPXAPGP-UHFFFAOYSA-N |
| XLogP | 83.15 |
| TPSA | 136.50 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 18 |
| Rotatable Bonds | 35 |
| Heavy Atoms | 334 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 4257.27 |
| LogP ≤ 5 | 83.15 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 18 |