6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole

C46H30N4 — CID 129221841

IUPAC6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole
SMILESc1ccc(-c2cc(-n3c4ccccc4c4c(-c5ccc6c(c5)c5cccnc5n6-c5ccccc5)cccc43)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/C46H30N4/c1-4-14-31(15-5-1)40-29-35(30-41(48-40)32-16-6-2-7-17-32)49-42-23-11-10-20-38(42)45-36(21-12-24-44(45)49)33-25-26-43-39(28-33)37-22-13-27-47-46(37)50(43)34-18-8-3-9-19-34/h1-30H
InChIKeyIWKMXWYWYIHRKY-UHFFFAOYSA-N
MW638.77 g/mol
LogP11.67
Rot. Bonds5

About 6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole

6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole (PubChem CID 129221841) has the molecular formula C46H30N4 and a molecular weight of 638.77 g/mol. Its IUPAC name is 6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole.

Molecular Properties

Compound Name6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole
PubChem CID129221841
Molecular FormulaC46H30N4
Molecular Weight638.77 g/mol
Exact Mass638.25
IUPAC Name6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole
SMILESc1ccc(-c2cc(-n3c4ccccc4c4c(-c5ccc6c(c5)c5cccnc5n6-c5ccccc5)cccc43)cc(-c3ccccc3)n2)cc1
InChIInChI=1S/C46H30N4/c1-4-14-31(15-5-1)40-29-35(30-41(48-40)32-16-6-2-7-17-32)49-42-23-11-10-20-38(42)45-36(21-12-24-44(45)49)33-25-26-43-39(28-33)37-22-13-27-47-46(37)50(43)34-18-8-3-9-19-34/h1-30H
InChIKeyIWKMXWYWYIHRKY-UHFFFAOYSA-N
XLogP11.67
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500638.77
LogP ≤ 511.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;6-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole
CID 157443985
9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole;9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]-6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole
CID 158281604
6-[9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;6-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;6-[9-[3-(3,5-dipyridin-2-ylphenyl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole
CID 159460585
9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-7-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole
CID 118587050
9-[4-(3,5-dipyridin-2-ylphenyl)phenyl]-6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole;9-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indole
CID 158404712
3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;4-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylcarbazole
CID 158283831
7-[9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-9-phenylpyrido[2,3-b]indole
CID 129221779
3-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-4-yl]-9-phenylcarbazole
CID 118528300
9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-6-[9-[3-[6-[4-[3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]phenyl]-6-pyridin-2-yl-2-pyridinyl]-3-pyridinyl]phenyl]carbazol-4-yl]pyrido[2,3-b]indole
CID 163988969
8-[9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-4-yl]-5-phenylpyrido[3,2-b]indole
CID 129221860
3-[6-(9-phenylcarbazol-4-yl)pyrido[2,3-b]indol-9-yl]benzonitrile
CID 132917496
6-[9-(2,4-diphenylpyrimidin-5-yl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole;6-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole
CID 161381057

Frequently Asked Questions

What is the IUPAC name of 6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole?
The IUPAC name of 6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole (CID 129221841) is 6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole.
What is the SMILES notation for 6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole?
The canonical SMILES for 6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole is c1ccc(-c2cc(-n3c4ccccc4c4c(-c5ccc6c(c5)c5cccnc5n6-c5ccccc5)cccc43)cc(-c3ccccc3)n2)cc1.
What is the InChIKey of 6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole?
The InChIKey is IWKMXWYWYIHRKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H30N4/c1-4-14-31(15-5-1)40-29-35(30-41(48-40)32-16-6-2-7-17-32)49-42-23-11-10-20-38(42)45-36(21-12-24-44(45)49)33-25-26-43-39(28-33)37-22-13-27-47-46(37)50(43)34-18-8-3-9-19-34/h1-30H.
What are the key properties of 6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole?
6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole has a molecular weight of 638.77 g/mol, XLogP of 11.67, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylpyrido[2,3-b]indole is sourced from PubChem (CID 129221841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).