3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole

C46H30N2 — CID 118231204

IUPAC3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccc6ccccc6c5)cc4)ccc32)cc1
InChIInChI=1S/C46H30N2/c1-2-12-37(13-3-1)47-43-16-8-6-14-39(43)41-29-35(22-26-45(41)47)36-23-27-46-42(30-36)40-15-7-9-17-44(40)48(46)38-24-20-32(21-25-38)34-19-18-31-10-4-5-11-33(31)28-34/h1-30H
InChIKeyJTVCZXDIHXUCBS-UHFFFAOYSA-N
MW610.76 g/mol
LogP12.37
Rot. Bonds4

About 3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole

3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole (PubChem CID 118231204) has the molecular formula C46H30N2 and a molecular weight of 610.76 g/mol. Its IUPAC name is 3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
PubChem CID118231204
Molecular FormulaC46H30N2
Molecular Weight610.76 g/mol
Exact Mass610.24
IUPAC Name3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccc6ccccc6c5)cc4)ccc32)cc1
InChIInChI=1S/C46H30N2/c1-2-12-37(13-3-1)47-43-16-8-6-14-39(43)41-29-35(22-26-45(41)47)36-23-27-46-42(30-36)40-15-7-9-17-44(40)48(46)38-24-20-32(21-25-38)34-19-18-31-10-4-5-11-33(31)28-34/h1-30H
InChIKeyJTVCZXDIHXUCBS-UHFFFAOYSA-N
XLogP12.37
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500610.76
LogP ≤ 512.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[4-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]phenyl]-9-phenylcarbazole
CID 126764142
3-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
CID 164948724
2-naphthalen-2-yl-9-phenyl-6-(9-phenylcarbazol-3-yl)carbazole
CID 121262529
3-(9-phenylcarbazol-3-yl)-9-(6-phenylnaphthalen-2-yl)carbazole
CID 118581886
3-[4-(9-naphthalen-2-ylcarbazol-2-yl)phenyl]-9-phenylcarbazole
CID 118919603
N-(4-carbazol-9-ylphenyl)-4-[6-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-yl]-N-phenylaniline
CID 59501688
3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole
CID 20685483
3-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 90085403
4-(4-naphthalen-2-ylphenyl)-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]aniline
CID 59288178
3-(10-naphthalen-2-yl-2-phenylanthracen-9-yl)-9-phenylcarbazole
CID 176777777
N-(4-naphthalen-2-ylphenyl)-4-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 59288183
3-[3-[3-[3-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]phenyl]phenyl]-9-phenylcarbazole
CID 126764146

Frequently Asked Questions

What is the IUPAC name of 3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole?
The IUPAC name of 3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole (CID 118231204) is 3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole.
What is the SMILES notation for 3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole?
The canonical SMILES for 3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole is c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccc6ccccc6c5)cc4)ccc32)cc1.
What is the InChIKey of 3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole?
The InChIKey is JTVCZXDIHXUCBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H30N2/c1-2-12-37(13-3-1)47-43-16-8-6-14-39(43)41-29-35(22-26-45(41)47)36-23-27-46-42(30-36)40-15-7-9-17-44(40)48(46)38-24-20-32(21-25-38)34-19-18-31-10-4-5-11-33(31)28-34/h1-30H.
What are the key properties of 3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole?
3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole has a molecular weight of 610.76 g/mol, XLogP of 12.37, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole is sourced from PubChem (CID 118231204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).