9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole

C45H31N3 — CID 140799910

IUPAC9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)c(-n3ccnc3-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C45H31N3/c1-4-14-32(15-5-1)36-30-40(33-16-6-2-7-17-33)44(41(31-36)34-18-8-3-9-19-34)47-29-28-46-45(47)35-24-26-37(27-25-35)48-42-22-12-10-20-38(42)39-21-11-13-23-43(39)48/h1-31H
InChIKeyHARURSCPTDCDFT-UHFFFAOYSA-N
MW613.76 g/mol
LogP11.64
Rot. Bonds6

About 9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole

9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole (PubChem CID 140799910) has the molecular formula C45H31N3 and a molecular weight of 613.76 g/mol. Its IUPAC name is 9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole.

Molecular Properties

Compound Name9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole
PubChem CID140799910
Molecular FormulaC45H31N3
Molecular Weight613.76 g/mol
Exact Mass613.25
IUPAC Name9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)c(-n3ccnc3-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C45H31N3/c1-4-14-32(15-5-1)36-30-40(33-16-6-2-7-17-33)44(41(31-36)34-18-8-3-9-19-34)47-29-28-46-45(47)35-24-26-37(27-25-35)48-42-22-12-10-20-38(42)39-21-11-13-23-43(39)48/h1-31H
InChIKeyHARURSCPTDCDFT-UHFFFAOYSA-N
XLogP11.64
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500613.76
LogP ≤ 511.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-[4-[1-(2,6-dimethylphenyl)imidazol-2-yl]phenyl]-2,4-diphenylcarbazole
CID 140799994
9-[4-(1-phenylimidazol-2-yl)phenyl]carbazole
CID 140800069
9-[4-[1-(2,3,4,5,6-pentamethylphenyl)imidazol-2-yl]phenyl]carbazole
CID 140800046
9-[4-[1-(4,6-diphenylpyrimidin-2-yl)imidazol-2-yl]phenyl]carbazole
CID 90181035
9-[6-(2-phenylimidazol-1-yl)-9H-fluoren-3-yl]carbazole
CID 58037505
9-[6-[3-(9H-fluoren-3-yl)-2,4,6-trimethyl-5-(2-phenylimidazol-1-yl)phenyl]-9H-fluoren-3-yl]carbazole
CID 144541469
9-[4-[1-(2,4-diphenyl-6-propan-2-yl-3-pyridinyl)imidazol-2-yl]phenyl]-3-thiophen-2-ylcarbazole
CID 140800085
9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,5-diphenylphenyl)phenyl]phenyl]carbazole
CID 58943802
9-[4-(3,5-diphenylphenyl)phenyl]-2-[9-[4-(3,5-diphenylphenyl)phenyl]carbazol-2-yl]carbazole
CID 135166087
9-[3-carbazol-9-yl-5-[8-[2,4-dimethyl-3-(2-phenylimidazol-1-yl)phenyl]dibenzofuran-2-yl]phenyl]carbazole
CID 71278024
9-[4-[2-(4-carbazol-9-ylphenyl)-4-(2,4,6-triphenylphenyl)phenyl]phenyl]carbazole
CID 58943784
9-[4-[4-(4-carbazol-9-ylphenyl)-2-[3-phenyl-5-(3-phenylphenyl)phenyl]phenyl]phenyl]carbazole
CID 58879507

Frequently Asked Questions

What is the IUPAC name of 9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole?
The IUPAC name of 9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole (CID 140799910) is 9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole.
What is the SMILES notation for 9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole?
The canonical SMILES for 9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole is c1ccc(-c2cc(-c3ccccc3)c(-n3ccnc3-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(-c3ccccc3)c2)cc1.
What is the InChIKey of 9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole?
The InChIKey is HARURSCPTDCDFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H31N3/c1-4-14-32(15-5-1)36-30-40(33-16-6-2-7-17-33)44(41(31-36)34-18-8-3-9-19-34)47-29-28-46-45(47)35-24-26-37(27-25-35)48-42-22-12-10-20-38(42)39-21-11-13-23-43(39)48/h1-31H.
What are the key properties of 9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole?
9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole has a molecular weight of 613.76 g/mol, XLogP of 11.64, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[1-(2,4,6-triphenylphenyl)imidazol-2-yl]phenyl]carbazole is sourced from PubChem (CID 140799910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).