2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole

C36H25N5 — CID 153285337

IUPAC2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole
SMILESCn1c(-c2ccc3c4ccccc4n(-c4cccc(-c5ccccn5)c4)c3c2)nc2ccc(-c3ccccn3)cc21
InChIInChI=1S/C36H25N5/c1-40-35-22-25(31-13-5-7-20-38-31)16-18-32(35)39-36(40)26-15-17-29-28-11-2-3-14-33(28)41(34(29)23-26)27-10-8-9-24(21-27)30-12-4-6-19-37-30/h2-23H,1H3
InChIKeyZPTGEYTYXYFAOB-UHFFFAOYSA-N
MW527.63 g/mol
LogP8.46
Rot. Bonds4

About 2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole

2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole (PubChem CID 153285337) has the molecular formula C36H25N5 and a molecular weight of 527.63 g/mol. Its IUPAC name is 2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole.

Molecular Properties

Compound Name2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole
PubChem CID153285337
Molecular FormulaC36H25N5
Molecular Weight527.63 g/mol
Exact Mass527.21
IUPAC Name2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole
SMILESCn1c(-c2ccc3c4ccccc4n(-c4cccc(-c5ccccn5)c4)c3c2)nc2ccc(-c3ccccn3)cc21
InChIInChI=1S/C36H25N5/c1-40-35-22-25(31-13-5-7-20-38-31)16-18-32(35)39-36(40)26-15-17-29-28-11-2-3-14-33(28)41(34(29)23-26)27-10-8-9-24(21-27)30-12-4-6-19-37-30/h2-23H,1H3
InChIKeyZPTGEYTYXYFAOB-UHFFFAOYSA-N
XLogP8.46
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500527.63
LogP ≤ 58.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-6-pyridin-2-yl-9-(3-pyridin-2-ylphenyl)carbazole
CID 153285580
2-[1-methyl-6-(4-phenylphenyl)benzimidazol-2-yl]-9-[3-(4-phenylphenyl)-5-pyridin-2-ylphenyl]carbazole
CID 153285674
2-(1-methylbenzimidazol-2-yl)-6-naphthalen-2-yl-9-(3-pyridin-2-ylphenyl)carbazole
CID 142328473
2-(1-methylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)-7-pyrrol-1-ylcarbazole
CID 142329038
2-[7-(1-methylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazol-3-yl]-1,3-oxazole
CID 142329290
2-(1-methylbenzimidazol-2-yl)-9-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]carbazole
CID 142328728
2-(1-methyl-5-pyridin-3-ylbenzimidazol-2-yl)-6-pyridin-3-yl-9-(3-pyridin-2-ylphenyl)carbazole
CID 142329407
2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole
CID 142328673
2-(1-methyl-7-pyridin-3-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole
CID 153285156
2-(1-methylbenzimidazol-2-yl)-9-(3-pyridin-2-yl-5-thiophen-3-ylphenyl)carbazole
CID 142328090
6-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]phenanthridine
CID 160823432
2-[4-(4-phenylphenyl)-2-pyridinyl]-9-(3-pyridin-2-ylphenyl)carbazole
CID 140825608

Frequently Asked Questions

What is the IUPAC name of 2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole?
The IUPAC name of 2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole (CID 153285337) is 2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole.
What is the SMILES notation for 2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole?
The canonical SMILES for 2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole is Cn1c(-c2ccc3c4ccccc4n(-c4cccc(-c5ccccn5)c4)c3c2)nc2ccc(-c3ccccn3)cc21.
What is the InChIKey of 2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole?
The InChIKey is ZPTGEYTYXYFAOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H25N5/c1-40-35-22-25(31-13-5-7-20-38-31)16-18-32(35)39-36(40)26-15-17-29-28-11-2-3-14-33(28)41(34(29)23-26)27-10-8-9-24(21-27)30-12-4-6-19-37-30/h2-23H,1H3.
What are the key properties of 2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole?
2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole has a molecular weight of 527.63 g/mol, XLogP of 8.46, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole is sourced from PubChem (CID 153285337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).