C228H139F10N11 — CID 157165175
2-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-4,6-dinaphthalen-2-ylpyrimidine;4-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-2,6-dinaphthalen-2-ylpyrimidine;2-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-4-phenyl-6-(4-phenylphenyl)pyrimidine;4-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-6-phenyl-2-(4-phenylphenyl)pyrimidine;2-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine (PubChem CID 157165175) has the molecular formula C228H139F10N11 and a molecular weight of 3222.68 g/mol. Its IUPAC name is 2-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-4,6-dinaphthalen-2-ylpyrimidine;4-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-2,6-dinaphthalen-2-ylpyrimidine;2-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-4-phenyl-6-(4-phenylphenyl)pyrimidine;4-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-6-phenyl-2-(4-phenylphenyl)pyrimidine;2-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine.
| Compound Name | 2-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-4,6-dinaphthalen-2-ylpyrimidine;4-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-2,6-dinaphthalen-2-ylpyrimidine;2-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-4-phenyl-6-(4-phenylphenyl)pyrimidine;4-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-6-phenyl-2-(4-phenylphenyl)pyrimidine;2-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine |
|---|---|
| PubChem CID | 157165175 |
| Molecular Formula | C228H139F10N11 |
| Molecular Weight | 3222.68 g/mol |
| Exact Mass | 3220.11 |
| IUPAC Name | 2-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-4,6-dinaphthalen-2-ylpyrimidine;4-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-2,6-dinaphthalen-2-ylpyrimidine;2-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-4-phenyl-6-(4-phenylphenyl)pyrimidine;4-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-6-phenyl-2-(4-phenylphenyl)pyrimidine;2-[7-(9,9-difluorofluoren-2-yl)naphthalen-2-yl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine |
| SMILES | FC1(F)c2ccccc2-c2ccc(-c3ccc4ccc(-c5cc(-c6ccc7ccccc7c6)nc(-c6ccc7ccccc7c6)n5)cc4c3)cc21.FC1(F)c2ccccc2-c2ccc(-c3ccc4ccc(-c5cc(-c6ccccc6)nc(-c6ccc(-c7ccccc7)cc6)n5)cc4c3)cc21.FC1(F)c2ccccc2-c2ccc(-c3ccc4ccc(-c5nc(-c6ccc7ccccc7c6)cc(-c6ccc7ccccc7c6)n5)cc4c3)cc21.FC1(F)c2ccccc2-c2ccc(-c3ccc4ccc(-c5nc(-c6ccccc6)cc(-c6ccc(-c7ccccc7)cc6)n5)cc4c3)cc21.FC1(F)c2ccccc2-c2ccc(-c3ccc4ccc(-c5nc(-c6ccccc6)nc(-c6ccc(-c7ccccc7)cc6)n5)cc4c3)cc21 |
| InChI | InChI=1S/2C47H28F2N2.2C45H28F2N2.C44H27F2N3/c48-47(49)42-12-6-5-11-40(42)41-22-21-35(27-43(41)47)34-17-13-31-15-19-37(26-39(31)25-34)45-28-44(36-18-14-29-7-1-3-9-32(29)23-36)50-46(51-45)38-20-16-30-8-2-4-10-33(30)24-38;48-47(49)42-12-6-5-11-40(42)41-22-21-35(27-43(41)47)34-17-13-31-16-20-38(26-39(31)25-34)46-50-44(36-18-14-29-7-1-3-9-32(29)23-36)28-45(51-46)37-19-15-30-8-2-4-10-33(30)24-37;46-45(47)40-14-8-7-13-38(40)39-24-23-35(27-41(39)45)34-21-17-31-18-22-36(26-37(31)25-34)43-28-42(32-11-5-2-6-12-32)48-44(49-43)33-19-15-30(16-20-33)29-9-3-1-4-10-29;46-45(47)40-14-8-7-13-38(40)39-24-23-35(27-41(39)45)34-21-17-31-18-22-36(26-37(31)25-34)44-48-42(32-11-5-2-6-12-32)28-43(49-44)33-19-15-30(16-20-33)29-9-3-1-4-10-29;45-44(46)39-14-8-7-13-37(39)38-24-23-34(27-40(38)44)33-21-17-30-18-22-35(26-36(30)25-33)43-48-41(31-11-5-2-6-12-31)47-42(49-43)32-19-15-29(16-20-32)28-9-3-1-4-10-28/h2*1-28H;2*1-28H;1-27H |
| InChIKey | AMVBSOFOIWPDMS-UHFFFAOYSA-N |
| XLogP | 61.10 |
| TPSA | 141.79 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 11 |
| Rotatable Bonds | 23 |
| Heavy Atoms | 249 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3222.68 |
| LogP ≤ 5 | 61.10 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 11 |