6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline

C53H33N5 — CID 134508826

IUPAC6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4ccc5c(c4)c4c6ccccc6ccc4n5-c4nc5ccccc5c5nc6ccccc6n45)c3)c2)cc1
InChIInChI=1S/C53H33N5/c1-3-14-34(15-4-1)40-32-46(36-17-5-2-6-18-36)54-47(33-40)39-20-13-19-37(30-39)38-27-28-48-43(31-38)51-41-21-8-7-16-35(41)26-29-50(51)57(48)53-56-44-23-10-9-22-42(44)52-55-45-24-11-12-25-49(45)58(52)53/h1-33H
InChIKeyAHGYTUQZIIMUAQ-UHFFFAOYSA-N
MW739.88 g/mol
LogP13.35
Rot. Bonds5

About 6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline

6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline (PubChem CID 134508826) has the molecular formula C53H33N5 and a molecular weight of 739.88 g/mol. Its IUPAC name is 6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline.

Molecular Properties

Compound Name6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline
PubChem CID134508826
Molecular FormulaC53H33N5
Molecular Weight739.88 g/mol
Exact Mass739.27
IUPAC Name6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4ccc5c(c4)c4c6ccccc6ccc4n5-c4nc5ccccc5c5nc6ccccc6n45)c3)c2)cc1
InChIInChI=1S/C53H33N5/c1-3-14-34(15-4-1)40-32-46(36-17-5-2-6-18-36)54-47(33-40)39-20-13-19-37(30-39)38-27-28-48-43(31-38)51-41-21-8-7-16-35(41)26-29-50(51)57(48)53-56-44-23-10-9-22-42(44)52-55-45-24-11-12-25-49(45)58(52)53/h1-33H
InChIKeyAHGYTUQZIIMUAQ-UHFFFAOYSA-N
XLogP13.35
TPSA48.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500739.88
LogP ≤ 513.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-[10-[3-(2,6-diphenyl-4-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline;6-[10-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline
CID 160667833
6-[10-[3,5-di(carbazol-9-yl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline;6-[10-(9-phenylcarbazol-2-yl)benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline;6-[10-[9-(4-phenylphenyl)carbazol-2-yl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline
CID 160944711
6-[10-(10-naphthalen-2-ylanthracen-9-yl)benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline
CID 134508875
6-[3-(4,6-diphenyl-2-pyridinyl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline;6-[3-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-9-yl]benzimidazolo[1,2-c]quinazoline;6-[3-(4-phenanthren-9-yl-6-phenyl-1,3,5-triazin-2-yl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline
CID 159551143
6-[10-(8-phenyldibenzothiophen-4-yl)benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline
CID 134508832
6-(10-dibenzofuran-3-ylbenzo[c]carbazol-7-yl)benzimidazolo[1,2-c]quinazoline
CID 134508838
6-(3-naphthalen-2-ylcarbazol-9-yl)benzimidazolo[1,2-c]quinazoline
CID 134508704
6-[3-(4-carbazol-9-ylphenyl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline
CID 134508650
6-(10-dibenzofuran-4-ylbenzo[c]carbazol-7-yl)benzimidazolo[1,2-c]quinazoline
CID 134508829
6-[3-(4-carbazol-9-ylphenyl)carbazol-9-yl]benzimidazolo[1,2-c]quinazoline;6-[3-[9-(4-phenylphenyl)carbazol-2-yl]carbazol-9-yl]benzimidazolo[1,2-c]quinazoline;6-[3-[9-(4-phenylphenyl)carbazol-3-yl]carbazol-9-yl]benzimidazolo[1,2-c]quinazoline
CID 158963688
6-[3-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]benzimidazolo[1,2-c]quinazoline
CID 134508649
6-(10-dibenzofuran-3-ylbenzo[c]carbazol-7-yl)benzimidazolo[1,2-c]quinazoline;6-[10-(4-dibenzofuran-3-ylphenyl)benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline;6-[10-(4-dibenzothiophen-3-ylphenyl)benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline
CID 162160682

Frequently Asked Questions

What is the IUPAC name of 6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline?
The IUPAC name of 6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline (CID 134508826) is 6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline.
What is the SMILES notation for 6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline?
The canonical SMILES for 6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline is c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4ccc5c(c4)c4c6ccccc6ccc4n5-c4nc5ccccc5c5nc6ccccc6n45)c3)c2)cc1.
What is the InChIKey of 6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline?
The InChIKey is AHGYTUQZIIMUAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H33N5/c1-3-14-34(15-4-1)40-32-46(36-17-5-2-6-18-36)54-47(33-40)39-20-13-19-37(30-39)38-27-28-48-43(31-38)51-41-21-8-7-16-35(41)26-29-50(51)57(48)53-56-44-23-10-9-22-42(44)52-55-45-24-11-12-25-49(45)58(52)53/h1-33H.
What are the key properties of 6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline?
6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline has a molecular weight of 739.88 g/mol, XLogP of 13.35, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[10-[3-(4,6-diphenyl-2-pyridinyl)phenyl]benzo[c]carbazol-7-yl]benzimidazolo[1,2-c]quinazoline is sourced from PubChem (CID 134508826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).