C276H168O6 — CID 162165156
4-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;4-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran;5-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;5-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran;6-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;7-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran (PubChem CID 162165156) has the molecular formula C276H168O6 and a molecular weight of 3580.37 g/mol. Its IUPAC name is 4-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;4-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran;5-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;5-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran;6-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;7-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran.
| Compound Name | 4-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;4-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran;5-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;5-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran;6-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;7-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran |
|---|---|
| PubChem CID | 162165156 |
| Molecular Formula | C276H168O6 |
| Molecular Weight | 3580.37 g/mol |
| Exact Mass | 3577.28 |
| IUPAC Name | 4-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;4-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran;5-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;5-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,1-b][1]benzofuran;6-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran;7-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]naphtho[2,3-b][1]benzofuran |
| SMILES | c1cc(-c2ccc3ccccc3c2)cc(-c2c3ccccc3c(-c3c4ccccc4cc4c3oc3ccccc34)c3ccccc23)c1.c1cc(-c2ccc3ccccc3c2)cc(-c2c3ccccc3c(-c3cc4c5ccccc5oc4c4ccccc34)c3ccccc23)c1.c1cc(-c2ccc3ccccc3c2)cc(-c2c3ccccc3c(-c3cc4oc5ccccc5c4c4ccccc34)c3ccccc23)c1.c1cc(-c2ccc3ccccc3c2)cc(-c2c3ccccc3c(-c3cccc4c3ccc3c5ccccc5oc43)c3ccccc23)c1.c1cc(-c2ccc3ccccc3c2)cc(-c2c3ccccc3c(-c3cccc4c3ccc3oc5ccccc5c34)c3ccccc23)c1.c1cc(-c2ccc3ccccc3c2)cc(-c2c3ccccc3c(-c3cccc4cc5c(cc34)oc3ccccc35)c3ccccc23)c1 |
| InChI | InChI=1S/6C46H28O/c1-2-13-30-26-32(25-24-29(30)12-1)31-14-11-15-33(27-31)44-36-18-4-6-20-38(36)45(39-21-7-5-19-37(39)44)41-28-42-35-17-9-10-23-43(35)47-46(42)40-22-8-3-16-34(40)41;1-2-12-30-25-32(24-23-29(30)11-1)31-13-9-15-34(26-31)45-36-17-3-5-19-38(36)46(39-20-6-4-18-37(39)45)40-21-10-14-33-27-42-35-16-7-8-22-43(35)47-44(42)28-41(33)40;1-2-12-30-27-32(24-23-29(30)11-1)31-13-9-14-33(28-31)44-37-16-3-5-18-39(37)45(40-19-6-4-17-38(40)44)36-20-10-21-41-34(36)25-26-42-35-15-7-8-22-43(35)47-46(41)42;1-2-12-30-27-32(24-23-29(30)11-1)31-13-9-14-33(28-31)44-37-15-3-5-17-39(37)45(40-18-6-4-16-38(40)44)35-20-10-21-36-34(35)25-26-43-46(36)41-19-7-8-22-42(41)47-43;1-2-13-30-26-32(25-24-29(30)12-1)31-14-11-15-33(27-31)44-36-18-5-7-20-38(36)45(39-21-8-6-19-37(39)44)41-28-43-46(35-17-4-3-16-34(35)41)40-22-9-10-23-42(40)47-43;1-2-13-30-26-32(25-24-29(30)12-1)31-15-11-16-34(27-31)43-37-19-5-7-21-39(37)44(40-22-8-6-20-38(40)43)45-35-17-4-3-14-33(35)28-41-36-18-9-10-23-42(36)47-46(41)45/h6*1-28H |
| InChIKey | ZNAIDKVWNCMJNG-UHFFFAOYSA-N |
| XLogP | 79.20 |
| TPSA | 78.84 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 18 |
| Heavy Atoms | 282 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3580.37 |
| LogP ≤ 5 | 79.20 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |
| Structural Alerts | {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'} |
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