2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole

C60H37NO — CID 155454157

IUPAC2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3ccc(-c4ccccc4-c4c5ccccc5c(-c5ccc6oc7cccc(-c8ccc9ccccc9c8)c7c6c5)c5ccccc45)cc32)cc1
InChIInChI=1S/C60H37NO/c1-2-17-43(18-3-1)61-54-27-13-12-20-46(54)47-33-31-41(37-55(47)61)44-19-6-7-21-48(44)59-51-24-10-8-22-49(51)58(50-23-9-11-25-52(50)59)42-32-34-56-53(36-42)60-45(26-14-28-57(60)62-56)40-30-29-38-15-4-5-16-39(38)35-40/h1-37H
InChIKeyQYRNMDFIULKXMN-UHFFFAOYSA-N
MW787.96 g/mol
LogP16.81
Rot. Bonds5

About 2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole

2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole (PubChem CID 155454157) has the molecular formula C60H37NO and a molecular weight of 787.96 g/mol. Its IUPAC name is 2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole.

Molecular Properties

Compound Name2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole
PubChem CID155454157
Molecular FormulaC60H37NO
Molecular Weight787.96 g/mol
Exact Mass787.29
IUPAC Name2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3ccc(-c4ccccc4-c4c5ccccc5c(-c5ccc6oc7cccc(-c8ccc9ccccc9c8)c7c6c5)c5ccccc45)cc32)cc1
InChIInChI=1S/C60H37NO/c1-2-17-43(18-3-1)61-54-27-13-12-20-46(54)47-33-31-41(37-55(47)61)44-19-6-7-21-48(44)59-51-24-10-8-22-49(51)58(50-23-9-11-25-52(50)59)42-32-34-56-53(36-42)60-45(26-14-28-57(60)62-56)40-30-29-38-15-4-5-16-39(38)35-40/h1-37H
InChIKeyQYRNMDFIULKXMN-UHFFFAOYSA-N
XLogP16.81
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500787.96
LogP ≤ 516.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

2-[2-(10-dibenzofuran-2-ylanthracen-9-yl)phenyl]-9-phenylcarbazole
CID 155454186
2-[9-(6-dibenzofuran-1-ylnaphthalen-2-yl)carbazol-2-yl]-9-phenylcarbazole
CID 126753215
9-phenyl-3-[10-[8-(10-phenylanthracen-9-yl)dibenzofuran-1-yl]anthracen-9-yl]carbazole
CID 158086462
1-dibenzofuran-2-yl-2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran;9-phenyl-2-[2-[4-(10-phenylanthracen-9-yl)phenyl]dibenzofuran-1-yl]carbazole
CID 167624935
3-[7-(4-dibenzofuran-3-yl-6-naphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]-9-phenylcarbazole
CID 139342726
3-[9-[4-naphthalen-2-yl-6-[8-(9-phenylcarbazol-3-yl)dibenzofuran-1-yl]-1,3,5-triazin-2-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 167377389
9-phenyl-3-(9-phenylcarbazol-2-yl)-6-[9-(9-triphenylen-2-ylcarbazol-3-yl)dibenzofuran-2-yl]carbazole
CID 147321695
3-dibenzofuran-1-yl-6-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-dibenzofuran-2-yl-6-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-dibenzofuran-3-yl-6-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole
CID 163841517
3-[9-(6-dibenzofuran-1-ylnaphthalen-1-yl)carbazol-2-yl]-9-phenylcarbazole
CID 118534204
3-[9-(4-dibenzofuran-2-yl-6-naphthalen-2-yl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]-9-phenylcarbazole
CID 163486477
2-[9-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]dibenzofuran-2-yl]-9-phenylcarbazole
CID 138475085
3-[9-(3-dibenzofuran-1-ylnaphthalen-1-yl)carbazol-2-yl]-9-phenylcarbazole
CID 126753308

Frequently Asked Questions

What is the IUPAC name of 2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole?
The IUPAC name of 2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole (CID 155454157) is 2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole.
What is the SMILES notation for 2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole?
The canonical SMILES for 2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole is c1ccc(-n2c3ccccc3c3ccc(-c4ccccc4-c4c5ccccc5c(-c5ccc6oc7cccc(-c8ccc9ccccc9c8)c7c6c5)c5ccccc45)cc32)cc1.
What is the InChIKey of 2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole?
The InChIKey is QYRNMDFIULKXMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H37NO/c1-2-17-43(18-3-1)61-54-27-13-12-20-46(54)47-33-31-41(37-55(47)61)44-19-6-7-21-48(44)59-51-24-10-8-22-49(51)58(50-23-9-11-25-52(50)59)42-32-34-56-53(36-42)60-45(26-14-28-57(60)62-56)40-30-29-38-15-4-5-16-39(38)35-40/h1-37H.
What are the key properties of 2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole?
2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole has a molecular weight of 787.96 g/mol, XLogP of 16.81, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[10-(9-naphthalen-2-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]-9-phenylcarbazole is sourced from PubChem (CID 155454157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).