C73H48N2O — CID 164769104
4-(4-carbazol-9-ylphenyl)-N-[4-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]phenyl]-N-phenylaniline (PubChem CID 164769104) has the molecular formula C73H48N2O and a molecular weight of 969.20 g/mol. Its IUPAC name is 4-(4-carbazol-9-ylphenyl)-N-[4-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]phenyl]-N-phenylaniline.
| Compound Name | 4-(4-carbazol-9-ylphenyl)-N-[4-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]phenyl]-N-phenylaniline |
|---|---|
| PubChem CID | 164769104 |
| Molecular Formula | C73H48N2O |
| Molecular Weight | 969.20 g/mol |
| Exact Mass | 968.38 |
| IUPAC Name | 4-(4-carbazol-9-ylphenyl)-N-[4-[9-(4-dibenzofuran-4-ylphenyl)-9-phenylfluoren-2-yl]phenyl]-N-phenylaniline |
| SMILES | c1ccc(N(c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)c2ccc(-c3ccc4c(c3)C(c3ccccc3)(c3ccc(-c5cccc6c5oc5ccccc56)cc3)c3ccccc3-4)cc2)cc1 |
| InChI | InChI=1S/C73H48N2O/c1-3-16-54(17-4-1)73(55-39-30-52(31-40-55)60-24-15-25-66-65-23-10-14-29-71(65)76-72(60)66)67-26-11-7-20-61(67)62-47-38-53(48-68(62)73)51-36-43-58(44-37-51)74(56-18-5-2-6-19-56)57-41-32-49(33-42-57)50-34-45-59(46-35-50)75-69-27-12-8-21-63(69)64-22-9-13-28-70(64)75/h1-48H |
| InChIKey | IPDCNCKAZIATLT-UHFFFAOYSA-N |
| XLogP | 19.52 |
| TPSA | 21.31 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 76 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 969.20 |
| LogP ≤ 5 | 19.52 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |