C144H94N2O — CID 165044312
4-[3-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]dibenzofuran;9-phenyl-4-[2-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]carbazole;9-phenyl-4-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]carbazole (PubChem CID 165044312) has the molecular formula C144H94N2O and a molecular weight of 1868.35 g/mol. Its IUPAC name is 4-[3-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]dibenzofuran;9-phenyl-4-[2-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]carbazole;9-phenyl-4-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]carbazole.
| Compound Name | 4-[3-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]dibenzofuran;9-phenyl-4-[2-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]carbazole;9-phenyl-4-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]carbazole |
|---|---|
| PubChem CID | 165044312 |
| Molecular Formula | C144H94N2O |
| Molecular Weight | 1868.35 g/mol |
| Exact Mass | 1866.74 |
| IUPAC Name | 4-[3-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]dibenzofuran;9-phenyl-4-[2-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]carbazole;9-phenyl-4-[3-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]carbazole |
| SMILES | c1ccc(-c2ccc(-c3c4ccccc4c(-c4cccc(-c5cccc6c5oc5ccccc56)c4)c4ccccc34)cc2)cc1.c1ccc(-c2ccccc2-c2c3ccccc3c(-c3cccc(-c4cccc5c4c4ccccc4n5-c4ccccc4)c3)c3ccccc23)cc1.c1ccc(-c2ccccc2-c2c3ccccc3c(-c3ccccc3-c3cccc4c3c3ccccc3n4-c3ccccc3)c3ccccc23)cc1 |
| InChI | InChI=1S/2C50H33N.C44H28O/c1-3-18-34(19-4-1)36-22-7-9-24-38(36)48-41-26-11-13-28-43(41)49(44-29-14-12-27-42(44)48)39-25-10-8-23-37(39)40-31-17-33-47-50(40)45-30-15-16-32-46(45)51(47)35-20-5-2-6-21-35;1-3-17-34(18-4-1)38-23-7-8-24-40(38)49-43-27-11-9-25-41(43)48(42-26-10-12-28-44(42)49)36-20-15-19-35(33-36)39-30-16-32-47-50(39)45-29-13-14-31-46(45)51(47)37-21-5-2-6-22-37;1-2-12-29(13-3-1)30-24-26-31(27-25-30)42-36-17-4-6-19-38(36)43(39-20-7-5-18-37(39)42)33-15-10-14-32(28-33)34-21-11-22-40-35-16-8-9-23-41(35)45-44(34)40/h2*1-33H;1-28H |
| InChIKey | OQHISMOPNOMPGU-UHFFFAOYSA-N |
| XLogP | 40.08 |
| TPSA | 23.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 14 |
| Heavy Atoms | 147 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1868.35 |
| LogP ≤ 5 | 40.08 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
| Structural Alerts | {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'} |
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