3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole

C49H32N4 — CID 159206818

IUPAC3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole
SMILESc1ccc(-c2nc3cc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)ccn3c2-c2ccccc2)cc1
InChIInChI=1S/C49H32N4/c1-4-14-33(15-5-1)48-49(34-16-6-2-7-17-34)51-29-28-38(32-47(51)50-48)53-44-23-13-11-21-40(44)42-31-36(25-27-46(42)53)35-24-26-45-41(30-35)39-20-10-12-22-43(39)52(45)37-18-8-3-9-19-37/h1-32H
InChIKeyANHIPNOZYDLXTK-UHFFFAOYSA-N
MW676.82 g/mol
LogP12.53
Rot. Bonds5

About 3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole

3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole (PubChem CID 159206818) has the molecular formula C49H32N4 and a molecular weight of 676.82 g/mol. Its IUPAC name is 3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole
PubChem CID159206818
Molecular FormulaC49H32N4
Molecular Weight676.82 g/mol
Exact Mass676.26
IUPAC Name3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole
SMILESc1ccc(-c2nc3cc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)ccn3c2-c2ccccc2)cc1
InChIInChI=1S/C49H32N4/c1-4-14-33(15-5-1)48-49(34-16-6-2-7-17-34)51-29-28-38(32-47(51)50-48)53-44-23-13-11-21-40(44)42-31-36(25-27-46(42)53)35-24-26-45-41(30-35)39-20-10-12-22-43(39)52(45)37-18-8-3-9-19-37/h1-32H
InChIKeyANHIPNOZYDLXTK-UHFFFAOYSA-N
XLogP12.53
TPSA27.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500676.82
LogP ≤ 512.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methane;9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[4-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]carbazole
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12-[4-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)phenyl]-11-phenylindolo[2,3-a]carbazole
CID 160666176
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CID 59489317
3,9-diphenyl-6-[3-(9-phenylcarbazol-3-yl)-5-(4-phenylphenyl)phenyl]carbazole
CID 122492191
3-(2,6-diphenyl-4-pyridinyl)-9-phenylcarbazole
CID 70934573
3-[4-[6-[3,5-bis(9-phenylcarbazol-3-yl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-9-phenylcarbazole
CID 58527032
3-[9-[4-(5-methyl-2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 155120354
9-phenyl-N-[4-[4-[N-(9-phenylcarbazol-3-yl)-3-(3-phenylimidazo[1,2-a]pyridin-2-yl)anilino]phenyl]phenyl]-N-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]carbazol-3-amine
CID 167376746
3-(9-phenylcarbazol-3-yl)-9-[3-[4-[3-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]quinazolin-2-yl]phenyl]carbazole
CID 121444205
9-phenyl-3-(9-phenylcarbazol-3-yl)-6-[9-[3-[2-[3-[3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]phenyl]quinazolin-4-yl]phenyl]carbazol-3-yl]carbazole
CID 122677106
3-(3-carbazol-9-ylphenyl)-6-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-phenylcarbazole
CID 58943700

Frequently Asked Questions

What is the IUPAC name of 3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole?
The IUPAC name of 3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole (CID 159206818) is 3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole.
What is the SMILES notation for 3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole?
The canonical SMILES for 3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole is c1ccc(-c2nc3cc(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)ccn3c2-c2ccccc2)cc1.
What is the InChIKey of 3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole?
The InChIKey is ANHIPNOZYDLXTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H32N4/c1-4-14-33(15-5-1)48-49(34-16-6-2-7-17-34)51-29-28-38(32-47(51)50-48)53-44-23-13-11-21-40(44)42-31-36(25-27-46(42)53)35-24-26-45-41(30-35)39-20-10-12-22-43(39)52(45)37-18-8-3-9-19-37/h1-32H.
What are the key properties of 3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole?
3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole has a molecular weight of 676.82 g/mol, XLogP of 12.53, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-(2,3-diphenylimidazo[1,2-a]pyridin-7-yl)carbazol-3-yl]-9-phenylcarbazole is sourced from PubChem (CID 159206818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).