About 6-bromo-3-[3-[3-[N-(6-bromo-9-phenylcarbazol-2-yl)-4-[6-(N-(6-bromo-9-phenylcarbazol-2-yl)anilino)naphthalen-2-yl]anilino]phenyl]phenyl]-9-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine
6-bromo-3-[3-[3-[N-(6-bromo-9-phenylcarbazol-2-yl)-4-[6-(N-(6-bromo-9-phenylcarbazol-2-yl)anilino)naphthalen-2-yl]anilino]phenyl]phenyl]-9-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine (PubChem CID 129194634) has the molecular formula C110H71Br3N6
and a molecular weight of 1716.53 g/mol. Its IUPAC name is 6-bromo-3-[3-[3-[N-(6-bromo-9-phenylcarbazol-2-yl)-4-[6-(N-(6-bromo-9-phenylcarbazol-2-yl)anilino)naphthalen-2-yl]anilino]phenyl]phenyl]-9-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine.
Molecular Properties
| Compound Name | 6-bromo-3-[3-[3-[N-(6-bromo-9-phenylcarbazol-2-yl)-4-[6-(N-(6-bromo-9-phenylcarbazol-2-yl)anilino)naphthalen-2-yl]anilino]phenyl]phenyl]-9-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine |
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| PubChem CID | 129194634 |
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| Molecular Formula | C110H71Br3N6 |
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| Molecular Weight | 1716.53 g/mol |
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| Exact Mass | 1712.33 |
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| IUPAC Name | 6-bromo-3-[3-[3-[N-(6-bromo-9-phenylcarbazol-2-yl)-4-[6-(N-(6-bromo-9-phenylcarbazol-2-yl)anilino)naphthalen-2-yl]anilino]phenyl]phenyl]-9-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine |
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| SMILES | Brc1ccc2c(c1)c1ccc(N(c3ccc(-c4ccc5cc(N(c6ccccc6)c6ccc7c8cc(Br)ccc8n(-c8ccccc8)c7c6)ccc5c4)cc3)c3cccc(-c4cccc(-c5cc6c7cc(Br)ccc7n(-c7ccc8ccccc8c7)c6cc5N(c5ccccc5)c5ccc(-c6ccccc6)cc5)c4)c3)cc1n2-c1ccccc1 |
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| InChI | InChI=1S/C110H71Br3N6/c111-83-44-57-104-100(65-83)97-55-53-95(68-107(97)117(104)88-31-12-4-13-32-88)114(86-27-8-2-9-28-86)93-52-43-80-60-79(36-37-81(80)64-93)75-40-47-90(48-41-75)115(96-54-56-98-101-66-84(112)45-58-105(101)118(108(98)69-96)89-33-14-5-15-34-89)92-35-19-25-78(63-92)76-24-18-26-82(61-76)99-70-103-102-67-85(113)46-59-106(102)119(94-51-42-73-22-16-17-23-77(73)62-94)110(103)71-109(99)116(87-29-10-3-11-30-87)91-49-38-74(39-50-91)72-20-6-1-7-21-72/h1-71H |
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| InChIKey | NOUWMQJQVUPXKY-UHFFFAOYSA-N |
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| XLogP | 32.65 |
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| TPSA | 24.51 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 6 |
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| Rotatable Bonds | 16 |
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| Heavy Atoms | 119 |
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| Complexity | — |
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Lipinski Rule of Five
2 violations
| Rule | Value |
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| MW ≤ 500 | 1716.53 |
| LogP ≤ 5 | 32.65 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |
Analyze 6-bromo-3-[3-[3-[N-(6-bromo-9-phenylcarbazol-2-yl)-4-[6-(N-(6-bromo-9-phenylcarbazol-2-yl)anilino)naphthalen-2-yl]anilino]phenyl]phenyl]-9-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine with MolForge
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Frequently Asked Questions
What is the IUPAC name of 6-bromo-3-[3-[3-[N-(6-bromo-9-phenylcarbazol-2-yl)-4-[6-(N-(6-bromo-9-phenylcarbazol-2-yl)anilino)naphthalen-2-yl]anilino]phenyl]phenyl]-9-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine?
The IUPAC name of 6-bromo-3-[3-[3-[N-(6-bromo-9-phenylcarbazol-2-yl)-4-[6-(N-(6-bromo-9-phenylcarbazol-2-yl)anilino)naphthalen-2-yl]anilino]phenyl]phenyl]-9-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine (CID 129194634) is 6-bromo-3-[3-[3-[N-(6-bromo-9-phenylcarbazol-2-yl)-4-[6-(N-(6-bromo-9-phenylcarbazol-2-yl)anilino)naphthalen-2-yl]anilino]phenyl]phenyl]-9-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine.
What is the SMILES notation for 6-bromo-3-[3-[3-[N-(6-bromo-9-phenylcarbazol-2-yl)-4-[6-(N-(6-bromo-9-phenylcarbazol-2-yl)anilino)naphthalen-2-yl]anilino]phenyl]phenyl]-9-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine?
The canonical SMILES for 6-bromo-3-[3-[3-[N-(6-bromo-9-phenylcarbazol-2-yl)-4-[6-(N-(6-bromo-9-phenylcarbazol-2-yl)anilino)naphthalen-2-yl]anilino]phenyl]phenyl]-9-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine is Brc1ccc2c(c1)c1ccc(N(c3ccc(-c4ccc5cc(N(c6ccccc6)c6ccc7c8cc(Br)ccc8n(-c8ccccc8)c7c6)ccc5c4)cc3)c3cccc(-c4cccc(-c5cc6c7cc(Br)ccc7n(-c7ccc8ccccc8c7)c6cc5N(c5ccccc5)c5ccc(-c6ccccc6)cc5)c4)c3)cc1n2-c1ccccc1.
What is the InChIKey of 6-bromo-3-[3-[3-[N-(6-bromo-9-phenylcarbazol-2-yl)-4-[6-(N-(6-bromo-9-phenylcarbazol-2-yl)anilino)naphthalen-2-yl]anilino]phenyl]phenyl]-9-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine?
The InChIKey is NOUWMQJQVUPXKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C110H71Br3N6/c111-83-44-57-104-100(65-83)97-55-53-95(68-107(97)117(104)88-31-12-4-13-32-88)114(86-27-8-2-9-28-86)93-52-43-80-60-79(36-37-81(80)64-93)75-40-47-90(48-41-75)115(96-54-56-98-101-66-84(112)45-58-105(101)118(108(98)69-96)89-33-14-5-15-34-89)92-35-19-25-78(63-92)76-24-18-26-82(61-76)99-70-103-102-67-85(113)46-59-106(102)119(94-51-42-73-22-16-17-23-77(73)62-94)110(103)71-109(99)116(87-29-10-3-11-30-87)91-49-38-74(39-50-91)72-20-6-1-7-21-72/h1-71H.
What are the key properties of 6-bromo-3-[3-[3-[N-(6-bromo-9-phenylcarbazol-2-yl)-4-[6-(N-(6-bromo-9-phenylcarbazol-2-yl)anilino)naphthalen-2-yl]anilino]phenyl]phenyl]-9-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine?
6-bromo-3-[3-[3-[N-(6-bromo-9-phenylcarbazol-2-yl)-4-[6-(N-(6-bromo-9-phenylcarbazol-2-yl)anilino)naphthalen-2-yl]anilino]phenyl]phenyl]-9-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine has a molecular weight of 1716.53 g/mol, XLogP of 32.65, 16 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-[3-[3-[N-(6-bromo-9-phenylcarbazol-2-yl)-4-[6-(N-(6-bromo-9-phenylcarbazol-2-yl)anilino)naphthalen-2-yl]anilino]phenyl]phenyl]-9-naphthalen-2-yl-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine is sourced from PubChem (CID 129194634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).