9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole

C45H29N3 — CID 90272257

IUPAC9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole
SMILESc1ccc2c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1
InChIInChI=1S/C45H29N3/c1-6-16-40-34(11-1)39(30-21-25-32(26-22-30)47-42-17-7-2-12-35(42)36-13-3-8-18-43(36)47)29-41(46-40)31-23-27-33(28-24-31)48-44-19-9-4-14-37(44)38-15-5-10-20-45(38)48/h1-29H
InChIKeyZCKLKKRXDCWDMK-UHFFFAOYSA-N
MW611.75 g/mol
LogP11.76
Rot. Bonds4

About 9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole

9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole (PubChem CID 90272257) has the molecular formula C45H29N3 and a molecular weight of 611.75 g/mol. Its IUPAC name is 9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole.

Molecular Properties

Compound Name9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole
PubChem CID90272257
Molecular FormulaC45H29N3
Molecular Weight611.75 g/mol
Exact Mass611.24
IUPAC Name9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole
SMILESc1ccc2c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1
InChIInChI=1S/C45H29N3/c1-6-16-40-34(11-1)39(30-21-25-32(26-22-30)47-42-17-7-2-12-35(42)36-13-3-8-18-43(36)47)29-41(46-40)31-23-27-33(28-24-31)48-44-19-9-4-14-37(44)38-15-5-10-20-45(38)48/h1-29H
InChIKeyZCKLKKRXDCWDMK-UHFFFAOYSA-N
XLogP11.76
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500611.75
LogP ≤ 511.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-carbazol-9-ylphenyl)-1-phenylbenzo[f]quinoline
CID 138643776
9-phenyl-4-(9-phenylcarbazol-3-yl)-2-(4-phenylquinolin-2-yl)carbazole
CID 154938716
9-[4-[3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-5-phenylphenyl]phenyl]carbazole
CID 58943692
9-[4-[4-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]naphthalen-1-yl]phenyl]carbazole
CID 167237400
9-[4-[3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]phenyl]phenyl]carbazole
CID 58943390
9-[4-[3-[3-[3-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 58943594
9-[4-[4-[3-[3-[3-[2,6-bis(4-carbazol-9-ylphenyl)-4-pyridinyl]phenyl]-5-phenylphenyl]phenyl]-6-(4-carbazol-9-ylphenyl)-2-pyridinyl]phenyl]carbazole
CID 58943378
9-[3-carbazol-9-yl-5-[4-[6-(4-carbazol-9-ylphenyl)-4-phenyl-2-pyridinyl]phenyl]phenyl]carbazole
CID 58526987
15-phenyl-11-[4-(4-phenylquinolin-2-yl)phenyl]-18-thia-11,15-diazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.019,24]heptacosa-1(16),2(14),3,5,7,9,12,17(25),19,21,23,26-dodecaene
CID 118546087
9-[4-[4-(4-carbazol-9-yl-2-phenylphenyl)phenyl]phenyl]carbazole;9-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]carbazole;2-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-4,6-diphenylpyrimidine;9-[4-[4-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]carbazole
CID 158730760
3-(9-phenylcarbazol-3-yl)-9-(4-quinolin-2-ylphenyl)carbazole
CID 118067290
9-[6-(4-carbazol-9-ylphenyl)-2-phenylpyrimidin-4-yl]-1,3-diphenylbenzo[f]quinoline
CID 166568862

Frequently Asked Questions

What is the IUPAC name of 9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole?
The IUPAC name of 9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole (CID 90272257) is 9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole.
What is the SMILES notation for 9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole?
The canonical SMILES for 9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole is c1ccc2c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1.
What is the InChIKey of 9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole?
The InChIKey is ZCKLKKRXDCWDMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H29N3/c1-6-16-40-34(11-1)39(30-21-25-32(26-22-30)47-42-17-7-2-12-35(42)36-13-3-8-18-43(36)47)29-41(46-40)31-23-27-33(28-24-31)48-44-19-9-4-14-37(44)38-15-5-10-20-45(38)48/h1-29H.
What are the key properties of 9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole?
9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole has a molecular weight of 611.75 g/mol, XLogP of 11.76, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[2-(4-carbazol-9-ylphenyl)quinolin-4-yl]phenyl]carbazole is sourced from PubChem (CID 90272257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).