3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole

C55H38N2 — CID 144560195

IUPAC3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole
SMILESCc1cc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)cc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc32)c1
InChIInChI=1S/C55H38N2/c1-37-29-42(45-32-43(38-15-5-2-6-16-38)31-44(33-45)39-17-7-3-8-18-39)34-47(30-37)57-52-23-13-11-21-48(52)50-27-25-41(36-55(50)57)40-26-28-54-51(35-40)49-22-12-14-24-53(49)56(54)46-19-9-4-10-20-46/h2-36H,1H3
InChIKeyFZGXEVWOEHKCTI-UHFFFAOYSA-N
MW726.92 g/mol
LogP14.86
Rot. Bonds6

About 3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole

3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole (PubChem CID 144560195) has the molecular formula C55H38N2 and a molecular weight of 726.92 g/mol. Its IUPAC name is 3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole
PubChem CID144560195
Molecular FormulaC55H38N2
Molecular Weight726.92 g/mol
Exact Mass726.30
IUPAC Name3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole
SMILESCc1cc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)cc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc32)c1
InChIInChI=1S/C55H38N2/c1-37-29-42(45-32-43(38-15-5-2-6-16-38)31-44(33-45)39-17-7-3-8-18-39)34-47(30-37)57-52-23-13-11-21-48(52)50-27-25-41(36-55(50)57)40-26-28-54-51(35-40)49-22-12-14-24-53(49)56(54)46-19-9-4-10-20-46/h2-36H,1H3
InChIKeyFZGXEVWOEHKCTI-UHFFFAOYSA-N
XLogP14.86
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500726.92
LogP ≤ 514.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[9-(4-carbazol-9-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-[9-(4-carbazol-9-ylphenyl)carbazol-2-yl]-9-(4-phenylphenyl)carbazole;3-[9-(3,5-dimethylphenyl)carbazol-2-yl]-9-[4-(3,5-dimethylphenyl)phenyl]carbazole;2-[9-[4-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-(3,5-diphenylphenyl)carbazole
CID 159256804
3-[9-(4-carbazol-9-ylphenyl)carbazol-2-yl]-9-phenylcarbazole;3-[9-(4-carbazol-9-ylphenyl)carbazol-2-yl]-9-(4-phenylphenyl)carbazole;2-[9-[4-(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-(3,5-diphenylphenyl)carbazole;3-(9-phenylcarbazol-2-yl)-9-(3-phenylphenyl)carbazole
CID 159224572
3-phenyl-9-[3-(9-phenylcarbazol-2-yl)-5-(4-phenylphenyl)phenyl]carbazole
CID 122492182
3,6-diphenyl-9-[3-phenyl-5-(9-phenylcarbazol-2-yl)phenyl]carbazole
CID 118084408
3-[9-[3,5-bis(3,5-dimethylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-(3,5-dimethylphenyl)carbazol-2-yl]-9-(3,5-diphenylphenyl)carbazole;2-[9-(3-naphthalen-2-yl-5-phenylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 159304245
3-(3-methyl-5-phenylphenyl)-9-phenylcarbazole
CID 123628919
2-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(3,5-diphenylphenyl)carbazol-2-yl]-9-(3-phenylphenyl)carbazole
CID 158200514
9-phenyl-2-[3-phenyl-5-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 129225606
3-[3-[9-(3,5-diphenylphenyl)carbazol-3-yl]phenyl]-9-phenylcarbazole;3-[3-[9-(3,5-diphenylphenyl)carbazol-2-yl]phenyl]-9-(4-phenylphenyl)carbazole;9-phenyl-3-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole;9-(3-phenylphenyl)-3-[3-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 159127106
3-[9-[3-methyl-5-(3-methylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 134370775
9-[4-(3,5-dimethylphenyl)phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole;9-[3-[3-(3,5-dimethylphenyl)phenyl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole;9-[4-[4-(3,5-dimethylphenyl)phenyl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole;9-[4-[4-[4-(3,5-dimethylphenyl)phenyl]phenyl]phenyl]-3,6-bis(9-phenylcarbazol-3-yl)carbazole
CID 162173783
3-[9-[3-[4-(3,5-dimethylphenyl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 134370607

Frequently Asked Questions

What is the IUPAC name of 3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole?
The IUPAC name of 3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole (CID 144560195) is 3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole.
What is the SMILES notation for 3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole?
The canonical SMILES for 3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole is Cc1cc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)cc(-n2c3ccccc3c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc32)c1.
What is the InChIKey of 3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole?
The InChIKey is FZGXEVWOEHKCTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H38N2/c1-37-29-42(45-32-43(38-15-5-2-6-16-38)31-44(33-45)39-17-7-3-8-18-39)34-47(30-37)57-52-23-13-11-21-48(52)50-27-25-41(36-55(50)57)40-26-28-54-51(35-40)49-22-12-14-24-53(49)56(54)46-19-9-4-10-20-46/h2-36H,1H3.
What are the key properties of 3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole?
3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole has a molecular weight of 726.92 g/mol, XLogP of 14.86, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-[3-(3,5-diphenylphenyl)-5-methylphenyl]carbazol-2-yl]-9-phenylcarbazole is sourced from PubChem (CID 144560195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).