C176H132N4 — CID 161235712
2-[3-[3-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine;2-[3-[4-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine;2-[4-[3-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine;2-[4-[4-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine (PubChem CID 161235712) has the molecular formula C176H132N4 and a molecular weight of 2303.02 g/mol. Its IUPAC name is 2-[3-[3-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine;2-[3-[4-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine;2-[4-[3-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine;2-[4-[4-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine.
| Compound Name | 2-[3-[3-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine;2-[3-[4-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine;2-[4-[3-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine;2-[4-[4-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine |
|---|---|
| PubChem CID | 161235712 |
| Molecular Formula | C176H132N4 |
| Molecular Weight | 2303.02 g/mol |
| Exact Mass | 2301.05 |
| IUPAC Name | 2-[3-[3-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine;2-[3-[4-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine;2-[4-[3-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine;2-[4-[4-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-4,6-diphenylpyridine |
| SMILES | CC1(C)c2ccccc2-c2cc(-c3ccc(-c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)cc4)cc3)ccc21.CC1(C)c2ccccc2-c2cc(-c3ccc(-c4cccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)c4)cc3)ccc21.CC1(C)c2ccccc2-c2cc(-c3cccc(-c4ccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)cc4)c3)ccc21.CC1(C)c2ccccc2-c2cc(-c3cccc(-c4cccc(-c5cc(-c6ccccc6)cc(-c6ccccc6)n5)c4)c3)ccc21 |
| InChI | InChI=1S/4C44H33N/c1-44(2)40-22-10-9-21-38(40)39-27-35(23-24-41(39)44)33-18-11-17-32(25-33)34-19-12-20-36(26-34)43-29-37(30-13-5-3-6-14-30)28-42(45-43)31-15-7-4-8-16-31;1-44(2)40-19-10-9-18-38(40)39-27-35(24-25-41(39)44)32-22-20-31(21-23-32)34-16-11-17-36(26-34)43-29-37(30-12-5-3-6-13-30)28-42(45-43)33-14-7-4-8-15-33;1-44(2)40-19-10-9-18-38(40)39-27-36(24-25-41(39)44)35-17-11-16-34(26-35)31-20-22-33(23-21-31)43-29-37(30-12-5-3-6-13-30)28-42(45-43)32-14-7-4-8-15-32;1-44(2)40-16-10-9-15-38(40)39-27-36(25-26-41(39)44)33-19-17-31(18-20-33)32-21-23-35(24-22-32)43-29-37(30-11-5-3-6-12-30)28-42(45-43)34-13-7-4-8-14-34/h4*3-29H,1-2H3 |
| InChIKey | UZIMGOATBIXRBC-UHFFFAOYSA-N |
| XLogP | 46.89 |
| TPSA | 51.56 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 20 |
| Heavy Atoms | 180 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2303.02 |
| LogP ≤ 5 | 46.89 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |