9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole

C63H42N2O — CID 71278034

IUPAC9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole
SMILESCC1(C)c2ccc(-c3ccc4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c4c3)cc2-c2ccc(-c3cc(-c4ccccc4)cc(-n4c5ccccc5c5ccccc54)c3)cc21
InChIInChI=1S/C63H42N2O/c1-63(2)55-29-25-40(41-26-30-61-53(36-41)54-38-45(27-31-62(54)66-61)64-57-20-10-6-16-48(57)49-17-7-11-21-58(49)64)35-52(55)47-28-24-42(37-56(47)63)44-32-43(39-14-4-3-5-15-39)33-46(34-44)65-59-22-12-8-18-50(59)51-19-9-13-23-60(51)65/h3-38H,1-2H3
InChIKeyPLRWLVOVFDSGER-UHFFFAOYSA-N
MW843.04 g/mol
LogP17.09
Rot. Bonds5

About 9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole

9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole (PubChem CID 71278034) has the molecular formula C63H42N2O and a molecular weight of 843.04 g/mol. Its IUPAC name is 9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole.

Molecular Properties

Compound Name9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole
PubChem CID71278034
Molecular FormulaC63H42N2O
Molecular Weight843.04 g/mol
Exact Mass842.33
IUPAC Name9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole
SMILESCC1(C)c2ccc(-c3ccc4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c4c3)cc2-c2ccc(-c3cc(-c4ccccc4)cc(-n4c5ccccc5c5ccccc54)c3)cc21
InChIInChI=1S/C63H42N2O/c1-63(2)55-29-25-40(41-26-30-61-53(36-41)54-38-45(27-31-62(54)66-61)64-57-20-10-6-16-48(57)49-17-7-11-21-58(49)64)35-52(55)47-28-24-42(37-56(47)63)44-32-43(39-14-4-3-5-15-39)33-46(34-44)65-59-22-12-8-18-50(59)51-19-9-13-23-60(51)65/h3-38H,1-2H3
InChIKeyPLRWLVOVFDSGER-UHFFFAOYSA-N
XLogP17.09
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms66
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500843.04
LogP ≤ 517.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-(7,7-dimethylfluoreno[2,3-b][1]benzofuran-2-yl)-3-(3,5-diphenylphenyl)-6-phenylcarbazole
CID 146647790
3-[9-(4-dibenzofuran-2-ylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-phenylcarbazole
CID 158323830
3-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9-(3,5-diphenylphenyl)carbazole
CID 129311960
3-(8-carbazol-9-yldibenzofuran-2-yl)-9-(3,5-diphenylphenyl)carbazole;ethane
CID 144605145
9-dibenzofuran-2-yl-2-[4-(9,9-dimethylfluoren-2-yl)phenyl]carbazole
CID 129312344
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]-9-(3,5-diphenylphenyl)carbazole
CID 159392904
3-[3-(9,9-dimethylfluoren-2-yl)phenyl]-9-(3,5-diphenylphenyl)carbazole
CID 129311922
3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(3,5-diphenylphenyl)carbazole
CID 71100014
9-[3-dibenzofuran-2-yl-5-[6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidin-4-yl]phenyl]carbazole
CID 67678611
3-[4-(9-dibenzofuran-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-[4-(9-dibenzothiophen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-[4-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]phenyl]-9-phenylcarbazole;3-[3-[9-(3,5-diphenylphenyl)carbazol-3-yl]phenyl]-9-phenylcarbazole;9-(3-phenylphenyl)-3-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 159640666
3,9-bis(9-phenylcarbazol-3-yl)carbazole;3-(9-dibenzofuran-2-ylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-(9-dibenzothiophen-2-ylcarbazol-3-yl)-9-(3-phenylphenyl)carbazole;3-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]-9-(3,5-diphenylphenyl)carbazole;3-[9-(9,9-dimethylfluoren-3-yl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 162097761
9-(11,11-dimethylfluoreno[3,2-b][1]benzofuran-9-yl)-3,6-diphenylcarbazole
CID 118098800

Frequently Asked Questions

What is the IUPAC name of 9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole?
The IUPAC name of 9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole (CID 71278034) is 9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole.
What is the SMILES notation for 9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole?
The canonical SMILES for 9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole is CC1(C)c2ccc(-c3ccc4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c4c3)cc2-c2ccc(-c3cc(-c4ccccc4)cc(-n4c5ccccc5c5ccccc54)c3)cc21.
What is the InChIKey of 9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole?
The InChIKey is PLRWLVOVFDSGER-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H42N2O/c1-63(2)55-29-25-40(41-26-30-61-53(36-41)54-38-45(27-31-62(54)66-61)64-57-20-10-6-16-48(57)49-17-7-11-21-58(49)64)35-52(55)47-28-24-42(37-56(47)63)44-32-43(39-14-4-3-5-15-39)33-46(34-44)65-59-22-12-8-18-50(59)51-19-9-13-23-60(51)65/h3-38H,1-2H3.
What are the key properties of 9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole?
9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole has a molecular weight of 843.04 g/mol, XLogP of 17.09, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-[6-(8-carbazol-9-yldibenzofuran-2-yl)-9,9-dimethylfluoren-2-yl]-5-phenylphenyl]carbazole is sourced from PubChem (CID 71278034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).