C274H164O8 — CID 167707786
2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzofuran;2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzofuran;2-(10-naphtho[1,2-b][1]benzofuran-8-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphtho[2,1-b][1]benzofuran-10-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-[4-(10-phenylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzofuran;2-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran (PubChem CID 167707786) has the molecular formula C274H164O8 and a molecular weight of 3584.32 g/mol. Its IUPAC name is 2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzofuran;2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzofuran;2-(10-naphtho[1,2-b][1]benzofuran-8-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphtho[2,1-b][1]benzofuran-10-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-[4-(10-phenylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzofuran;2-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran.
| Compound Name | 2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzofuran;2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzofuran;2-(10-naphtho[1,2-b][1]benzofuran-8-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphtho[2,1-b][1]benzofuran-10-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-[4-(10-phenylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzofuran;2-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran |
|---|---|
| PubChem CID | 167707786 |
| Molecular Formula | C274H164O8 |
| Molecular Weight | 3584.32 g/mol |
| Exact Mass | 3581.24 |
| IUPAC Name | 2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzofuran;2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzofuran;2-(10-naphtho[1,2-b][1]benzofuran-8-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-(10-naphtho[2,1-b][1]benzofuran-10-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran;2-[4-(10-phenylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzofuran;2-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran |
| SMILES | c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5oc6cc7ccccc7cc6c5c4)cc3)c3ccccc23)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5ccc6oc7cc8ccccc8cc7c6c5)cc4)c4ccccc34)cc2)cc1.c1ccc2cc(-c3c4ccccc4c(-c4ccc(-c5ccc6oc7cc8ccccc8cc7c6c5)cc4)c4ccccc34)ccc2c1.c1ccc2cc3c(cc2c1)oc1ccc(-c2c4ccccc4c(-c4ccc5oc6c7ccccc7ccc6c5c4)c4ccccc24)cc13.c1ccc2cc3c(cc2c1)oc1ccc(-c2c4ccccc4c(-c4ccc5oc6ccc7ccccc7c6c5c4)c4ccccc24)cc13.c1ccc2cc3c(cc2c1)oc1ccc(-c2ccc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)cc2)cc13 |
| InChI | InChI=1S/C48H30O.2C46H26O2.2C46H28O.C42H26O/c1-2-10-31(11-3-1)32-18-22-34(23-19-32)47-39-14-6-8-16-41(39)48(42-17-9-7-15-40(42)47)35-24-20-33(21-25-35)38-26-27-45-43(29-38)44-28-36-12-4-5-13-37(36)30-46(44)49-45;1-2-11-29-26-43-38(23-28(29)10-1)37-24-30(18-20-40(37)48-43)44-33-13-5-7-15-35(33)45(36-16-8-6-14-34(36)44)31-19-21-41-39(25-31)46-32-12-4-3-9-27(32)17-22-42(46)47-41;1-2-11-29-26-43-40(23-28(29)10-1)39-25-31(18-21-41(39)47-43)45-35-15-7-5-13-33(35)44(34-14-6-8-16-36(34)45)30-19-22-42-38(24-30)37-20-17-27-9-3-4-12-32(27)46(37)48-42;1-2-12-33-28-44-42(26-32(33)11-1)41-27-34(24-25-43(41)47-44)29-20-22-31(23-21-29)45-37-15-5-7-17-39(37)46(40-18-8-6-16-38(40)45)36-19-9-13-30-10-3-4-14-35(30)36;1-2-10-32-25-36(22-19-29(32)9-1)46-39-15-7-5-13-37(39)45(38-14-6-8-16-40(38)46)31-20-17-30(18-21-31)35-23-24-43-41(27-35)42-26-33-11-3-4-12-34(33)28-44(42)47-43;1-2-10-28(11-3-1)41-33-14-6-8-16-35(33)42(36-17-9-7-15-34(36)41)29-20-18-27(19-21-29)32-22-23-39-37(25-32)38-24-30-12-4-5-13-31(30)26-40(38)43-39/h1-30H;2*1-26H;2*1-28H;1-26H |
| InChIKey | ZJDPYCSIPNQDCV-UHFFFAOYSA-N |
| XLogP | 79.02 |
| TPSA | 105.12 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 17 |
| Heavy Atoms | 282 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3584.32 |
| LogP ≤ 5 | 79.02 |
| 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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