About 3-(3-carbazol-9-yldibenzofuran-4-yl)-9-isoquinolin-8-ylcarbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-(2-methyl-1,8-naphthyridin-4-yl)carbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-quinolin-5-ylcarbazole
3-(3-carbazol-9-yldibenzofuran-4-yl)-9-isoquinolin-8-ylcarbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-(2-methyl-1,8-naphthyridin-4-yl)carbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-quinolin-5-ylcarbazole (PubChem CID 157466053) has the molecular formula C135H82N10O3
and a molecular weight of 1892.21 g/mol. Its IUPAC name is 3-(3-carbazol-9-yldibenzofuran-4-yl)-9-isoquinolin-8-ylcarbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-(2-methyl-1,8-naphthyridin-4-yl)carbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-quinolin-5-ylcarbazole.
Molecular Properties
| Compound Name | 3-(3-carbazol-9-yldibenzofuran-4-yl)-9-isoquinolin-8-ylcarbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-(2-methyl-1,8-naphthyridin-4-yl)carbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-quinolin-5-ylcarbazole |
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| PubChem CID | 157466053 |
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| Molecular Formula | C135H82N10O3 |
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| Molecular Weight | 1892.21 g/mol |
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| Exact Mass | 1890.66 |
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| IUPAC Name | 3-(3-carbazol-9-yldibenzofuran-4-yl)-9-isoquinolin-8-ylcarbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-(2-methyl-1,8-naphthyridin-4-yl)carbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-quinolin-5-ylcarbazole |
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| SMILES | Cc1cc(-n2c3ccccc3c3ccc(-c4c(-n5c6ccccc6c6ccccc65)ccc5c4oc4ccccc45)cc32)c2cccnc2n1.c1cc(-n2c3ccccc3c3cc(-c4c(-n5c6ccccc6c6ccccc65)ccc5c4oc4ccccc45)ccc32)c2cnccc2c1.c1cc(-n2c3ccccc3c3ccc(-c4c(-n5c6ccccc6c6ccccc65)ccc5c4oc4ccccc45)cc32)c2cccnc2c1 |
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| InChI | InChI=1S/C45H28N4O.2C45H27N3O/c1-27-25-40(35-15-10-24-46-45(35)47-27)49-38-18-8-4-13-31(38)32-21-20-28(26-41(32)49)43-39(23-22-34-33-14-5-9-19-42(33)50-44(34)43)48-36-16-6-2-11-29(36)30-12-3-7-17-37(30)48;1-5-17-37-29(11-1)30-12-2-6-18-38(30)47(37)41-25-24-34-33-14-4-8-21-43(33)49-45(34)44(41)28-22-23-32-31-13-3-7-19-39(31)48(42(32)27-28)40-20-9-16-36-35(40)15-10-26-46-36;1-5-15-37-30(11-1)31-12-2-6-16-38(31)48(37)42-23-21-34-33-14-4-8-19-43(33)49-45(34)44(42)29-20-22-41-35(26-29)32-13-3-7-17-39(32)47(41)40-18-9-10-28-24-25-46-27-36(28)40/h2-26H,1H3;2*1-27H |
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| InChIKey | BUMLKWNUKKOGBZ-UHFFFAOYSA-N |
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| XLogP | 35.69 |
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| TPSA | 120.56 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 13 |
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| Rotatable Bonds | 9 |
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| Heavy Atoms | 148 |
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| Complexity | — |
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Lipinski Rule of Five
3 violations
| Rule | Value |
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| MW ≤ 500 | 1892.21 |
| LogP ≤ 5 | 35.69 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 13 |
Analyze 3-(3-carbazol-9-yldibenzofuran-4-yl)-9-isoquinolin-8-ylcarbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-(2-methyl-1,8-naphthyridin-4-yl)carbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-quinolin-5-ylcarbazole with MolForge
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Frequently Asked Questions
What is the IUPAC name of 3-(3-carbazol-9-yldibenzofuran-4-yl)-9-isoquinolin-8-ylcarbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-(2-methyl-1,8-naphthyridin-4-yl)carbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-quinolin-5-ylcarbazole?
The IUPAC name of 3-(3-carbazol-9-yldibenzofuran-4-yl)-9-isoquinolin-8-ylcarbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-(2-methyl-1,8-naphthyridin-4-yl)carbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-quinolin-5-ylcarbazole (CID 157466053) is 3-(3-carbazol-9-yldibenzofuran-4-yl)-9-isoquinolin-8-ylcarbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-(2-methyl-1,8-naphthyridin-4-yl)carbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-quinolin-5-ylcarbazole.
What is the SMILES notation for 3-(3-carbazol-9-yldibenzofuran-4-yl)-9-isoquinolin-8-ylcarbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-(2-methyl-1,8-naphthyridin-4-yl)carbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-quinolin-5-ylcarbazole?
The canonical SMILES for 3-(3-carbazol-9-yldibenzofuran-4-yl)-9-isoquinolin-8-ylcarbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-(2-methyl-1,8-naphthyridin-4-yl)carbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-quinolin-5-ylcarbazole is Cc1cc(-n2c3ccccc3c3ccc(-c4c(-n5c6ccccc6c6ccccc65)ccc5c4oc4ccccc45)cc32)c2cccnc2n1.c1cc(-n2c3ccccc3c3cc(-c4c(-n5c6ccccc6c6ccccc65)ccc5c4oc4ccccc45)ccc32)c2cnccc2c1.c1cc(-n2c3ccccc3c3ccc(-c4c(-n5c6ccccc6c6ccccc65)ccc5c4oc4ccccc45)cc32)c2cccnc2c1.
What is the InChIKey of 3-(3-carbazol-9-yldibenzofuran-4-yl)-9-isoquinolin-8-ylcarbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-(2-methyl-1,8-naphthyridin-4-yl)carbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-quinolin-5-ylcarbazole?
The InChIKey is BUMLKWNUKKOGBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H28N4O.2C45H27N3O/c1-27-25-40(35-15-10-24-46-45(35)47-27)49-38-18-8-4-13-31(38)32-21-20-28(26-41(32)49)43-39(23-22-34-33-14-5-9-19-42(33)50-44(34)43)48-36-16-6-2-11-29(36)30-12-3-7-17-37(30)48;1-5-17-37-29(11-1)30-12-2-6-18-38(30)47(37)41-25-24-34-33-14-4-8-21-43(33)49-45(34)44(41)28-22-23-32-31-13-3-7-19-39(31)48(42(32)27-28)40-20-9-16-36-35(40)15-10-26-46-36;1-5-15-37-30(11-1)31-12-2-6-16-38(31)48(37)42-23-21-34-33-14-4-8-19-43(33)49-45(34)44(42)29-20-22-41-35(26-29)32-13-3-7-17-39(32)47(41)40-18-9-10-28-24-25-46-27-36(28)40/h2-26H,1H3;2*1-27H.
What are the key properties of 3-(3-carbazol-9-yldibenzofuran-4-yl)-9-isoquinolin-8-ylcarbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-(2-methyl-1,8-naphthyridin-4-yl)carbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-quinolin-5-ylcarbazole?
3-(3-carbazol-9-yldibenzofuran-4-yl)-9-isoquinolin-8-ylcarbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-(2-methyl-1,8-naphthyridin-4-yl)carbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-quinolin-5-ylcarbazole has a molecular weight of 1892.21 g/mol, XLogP of 35.69, 9 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-carbazol-9-yldibenzofuran-4-yl)-9-isoquinolin-8-ylcarbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-(2-methyl-1,8-naphthyridin-4-yl)carbazole;2-(3-carbazol-9-yldibenzofuran-4-yl)-9-quinolin-5-ylcarbazole is sourced from PubChem (CID 157466053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).