C115H77N7 — CID 164973496
N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine (PubChem CID 164973496) has the molecular formula C115H77N7 and a molecular weight of 1556.93 g/mol. Its IUPAC name is N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine.
| Compound Name | N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine |
|---|---|
| PubChem CID | 164973496 |
| Molecular Formula | C115H77N7 |
| Molecular Weight | 1556.93 g/mol |
| Exact Mass | 1555.62 |
| IUPAC Name | N-(9H-fluoren-2-yl)-9-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine;9-phenyl-N-(9-phenylcarbazol-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-2-amine |
| SMILES | c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6c(c5)Cc5ccccc5-6)c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc4)ccc32)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc(N(c5ccc6c7ccccc7n(-c7ccccc7)c6c5)c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc4)ccc32)cc1 |
| InChI | InChI=1S/C60H40N4.C55H37N3/c1-4-16-43(17-5-1)62-57-27-15-12-24-51(57)54-38-42(30-37-58(54)62)41-28-31-46(32-29-41)61(47-33-35-52-49-22-10-13-25-55(49)63(59(52)39-47)44-18-6-2-7-19-44)48-34-36-53-50-23-11-14-26-56(50)64(60(53)40-48)45-20-8-3-9-21-45;1-3-14-41(15-4-1)57-53-22-12-10-20-49(53)51-35-38(25-32-54(51)57)37-23-26-43(27-24-37)56(44-28-30-47-40(34-44)33-39-13-7-8-18-46(39)47)45-29-31-50-48-19-9-11-21-52(48)58(55(50)36-45)42-16-5-2-6-17-42/h1-40H;1-32,34-36H,33H2 |
| InChIKey | DLHSAEDAMCXZSY-UHFFFAOYSA-N |
| XLogP | 30.70 |
| TPSA | 31.13 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Heavy Atoms | 122 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1556.93 |
| LogP ≤ 5 | 30.70 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 7 |