5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole

C55H36N2 — CID 166002881

IUPAC5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4c(-c6ccc(C7c8ccccc8-c8ccccc87)cc6)cccc4n5-c4ccccc4)ccc32)cc1
InChIInChI=1S/C55H36N2/c1-3-14-40(15-4-1)56-50-24-12-11-20-45(50)48-34-38(30-32-51(48)56)39-31-33-52-49(35-39)55-42(23-13-25-53(55)57(52)41-16-5-2-6-17-41)36-26-28-37(29-27-36)54-46-21-9-7-18-43(46)44-19-8-10-22-47(44)54/h1-35,54H
InChIKeyXMRLSHVBRUVZNM-UHFFFAOYSA-N
MW724.91 g/mol
LogP14.38
Rot. Bonds5

About 5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole

5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole (PubChem CID 166002881) has the molecular formula C55H36N2 and a molecular weight of 724.91 g/mol. Its IUPAC name is 5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole.

Molecular Properties

Compound Name5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
PubChem CID166002881
Molecular FormulaC55H36N2
Molecular Weight724.91 g/mol
Exact Mass724.29
IUPAC Name5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4c(-c6ccc(C7c8ccccc8-c8ccccc87)cc6)cccc4n5-c4ccccc4)ccc32)cc1
InChIInChI=1S/C55H36N2/c1-3-14-40(15-4-1)56-50-24-12-11-20-45(50)48-34-38(30-32-51(48)56)39-31-33-52-49(35-39)55-42(23-13-25-53(55)57(52)41-16-5-2-6-17-41)36-26-28-37(29-27-36)54-46-21-9-7-18-43(46)44-19-8-10-22-47(44)54/h1-35,54H
InChIKeyXMRLSHVBRUVZNM-UHFFFAOYSA-N
XLogP14.38
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500724.91
LogP ≤ 514.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-phenyl-3-[3-(9-phenylcarbazol-3-yl)-9H-fluoren-9-yl]carbazole
CID 118423662
9-phenyl-3-(9-phenylcarbazol-3-yl)-5-[4-(4-phenylphenyl)phenyl]carbazole
CID 134369783
3-[4-[(9R)-3-(3-carbazol-9-ylphenyl)-9H-fluoren-9-yl]phenyl]-9-(4-phenylphenyl)carbazole
CID 170074676
5,9-diphenyl-3-(9-phenylcarbazol-3-yl)carbazole;5-phenyl-3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 160685377
5,9-diphenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4-phenylphenyl)-3-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 162115946
9-phenyl-5-(4-phenylphenyl)-3-[9-[4-(4-phenylphenyl)phenyl]carbazol-3-yl]carbazole
CID 170073009
3-(9-phenyl-9H-fluoren-3-yl)-9-(4-phenylphenyl)carbazole
CID 170253658
N,5,9-triphenyl-N-[4-(3-phenyl-9H-fluoren-9-yl)phenyl]carbazol-3-amine
CID 169009813
5,9-diphenyl-3-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazole
CID 177113345
3-[9-[3-(4-carbazol-9-ylphenyl)phenyl]-9H-fluoren-3-yl]-9-phenylcarbazole
CID 170060039
5,9-diphenyl-3-(9-triphenylen-2-ylcarbazol-3-yl)carbazole
CID 134369810
4-phenyl-9-(9-phenyl-9H-fluoren-3-yl)carbazole
CID 171458068

Frequently Asked Questions

What is the IUPAC name of 5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole?
The IUPAC name of 5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole (CID 166002881) is 5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole.
What is the SMILES notation for 5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole?
The canonical SMILES for 5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole is c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4c(-c6ccc(C7c8ccccc8-c8ccccc87)cc6)cccc4n5-c4ccccc4)ccc32)cc1.
What is the InChIKey of 5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole?
The InChIKey is XMRLSHVBRUVZNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H36N2/c1-3-14-40(15-4-1)56-50-24-12-11-20-45(50)48-34-38(30-32-51(48)56)39-31-33-52-49(35-39)55-42(23-13-25-53(55)57(52)41-16-5-2-6-17-41)36-26-28-37(29-27-36)54-46-21-9-7-18-43(46)44-19-8-10-22-47(44)54/h1-35,54H.
What are the key properties of 5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole?
5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole has a molecular weight of 724.91 g/mol, XLogP of 14.38, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(9H-fluoren-9-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole is sourced from PubChem (CID 166002881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).