C136H88N8 — CID 161402037
N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine (PubChem CID 161402037) has the molecular formula C136H88N8 and a molecular weight of 1834.26 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine.
| Compound Name | N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine |
|---|---|
| PubChem CID | 161402037 |
| Molecular Formula | C136H88N8 |
| Molecular Weight | 1834.26 g/mol |
| Exact Mass | 1832.71 |
| IUPAC Name | N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-1-amine;N-(4-carbazol-9-ylphenyl)-N-phenyl-9,10-bis(2-quinolin-7-ylphenyl)anthracen-2-amine |
| SMILES | c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc3c(-c4ccccc4-c4ccc5cccnc5c4)c4ccccc4c(-c4ccccc4-c4ccc5cccnc5c4)c3c2)cc1.c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2cccc3c(-c4ccccc4-c4ccc5cccnc5c4)c4ccccc4c(-c4ccccc4-c4ccc5cccnc5c4)c23)cc1 |
| InChI | InChI=1S/2C68H44N4/c1-2-19-49(20-3-1)71(50-37-39-51(40-38-50)72-63-30-12-10-23-54(63)55-24-11-13-31-64(55)72)65-32-14-29-60-66(56-25-6-4-21-52(56)47-35-33-45-17-15-41-69-61(45)43-47)58-27-8-9-28-59(58)67(68(60)65)57-26-7-5-22-53(57)48-36-34-46-18-16-42-70-62(46)44-48;1-2-18-49(19-3-1)71(50-34-36-51(37-35-50)72-65-28-12-10-22-55(65)56-23-11-13-29-66(56)72)52-38-39-61-62(44-52)68(58-25-7-5-21-54(58)48-33-31-46-17-15-41-70-64(46)43-48)60-27-9-8-26-59(60)67(61)57-24-6-4-20-53(57)47-32-30-45-16-14-40-69-63(45)42-47/h2*1-44H |
| InChIKey | VUIZZZXVZATMNI-UHFFFAOYSA-N |
| XLogP | 36.65 |
| TPSA | 67.90 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 16 |
| Heavy Atoms | 144 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1834.26 |
| LogP ≤ 5 | 36.65 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 8 |
| Structural Alerts | {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'} |
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