2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole

C35H26N6 — CID 142328673

IUPAC2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole
SMILESCn1ccnc1-c1cccc2nc(-c3ccc4c5ccccc5n(-c5cccc(-c6ccccn6)c5)c4c3)n(C)c12
InChIInChI=1S/C35H26N6/c1-39-20-19-37-35(39)28-12-8-14-30-33(28)40(2)34(38-30)24-16-17-27-26-11-3-4-15-31(26)41(32(27)22-24)25-10-7-9-23(21-25)29-13-5-6-18-36-29/h3-22H,1-2H3
InChIKeyAWVZBURAHXAQTE-UHFFFAOYSA-N
MW530.64 g/mol
LogP7.80
Rot. Bonds4

About 2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole

2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole (PubChem CID 142328673) has the molecular formula C35H26N6 and a molecular weight of 530.64 g/mol. Its IUPAC name is 2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole.

Molecular Properties

Compound Name2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole
PubChem CID142328673
Molecular FormulaC35H26N6
Molecular Weight530.64 g/mol
Exact Mass530.22
IUPAC Name2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole
SMILESCn1ccnc1-c1cccc2nc(-c3ccc4c5ccccc5n(-c5cccc(-c6ccccn6)c5)c4c3)n(C)c12
InChIInChI=1S/C35H26N6/c1-39-20-19-37-35(39)28-12-8-14-30-33(28)40(2)34(38-30)24-16-17-27-26-11-3-4-15-31(26)41(32(27)22-24)25-10-7-9-23(21-25)29-13-5-6-18-36-29/h3-22H,1-2H3
InChIKeyAWVZBURAHXAQTE-UHFFFAOYSA-N
XLogP7.80
TPSA53.46 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500530.64
LogP ≤ 57.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(1-methyl-7-pyridin-3-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole
CID 153285156
2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazole
CID 153285337
2-(1-methyl-6-pyridin-2-ylbenzimidazol-2-yl)-6-pyridin-2-yl-9-(3-pyridin-2-ylphenyl)carbazole
CID 153285580
2-(1-methylbenzimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)-7-pyrrol-1-ylcarbazole
CID 142329038
2-(1-methylbenzimidazol-2-yl)-6-naphthalen-2-yl-9-(3-pyridin-2-ylphenyl)carbazole
CID 142328473
2-[4-(1-methylimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazol-2-yl]-1,3-benzothiazole
CID 153285439
5-(1-methylimidazol-2-yl)-2-[6-(1-methylimidazol-2-yl)-9-(3-pyridin-2-ylphenyl)carbazol-2-yl]-1,3-benzoxazole
CID 142328663
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-[2-(1-methylimidazol-2-yl)-5-[5-(1-methylimidazol-2-yl)-2-pyridinyl]phenyl]carbazole
CID 142328204
7-pyridin-2-yl-2-[9-(3-pyridin-2-ylphenyl)carbazol-2-yl]-1,3-benzothiazole
CID 142329340
2-(1-methylbenzimidazol-2-yl)-9-[3-(6-pyridin-4-yl-2-pyridinyl)phenyl]carbazole
CID 142328728
2-[1-methyl-6-(4-phenylphenyl)benzimidazol-2-yl]-9-[3-(4-phenylphenyl)-5-pyridin-2-ylphenyl]carbazole
CID 153285674

Frequently Asked Questions

What is the IUPAC name of 2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole?
The IUPAC name of 2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole (CID 142328673) is 2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole.
What is the SMILES notation for 2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole?
The canonical SMILES for 2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole is Cn1ccnc1-c1cccc2nc(-c3ccc4c5ccccc5n(-c5cccc(-c6ccccn6)c5)c4c3)n(C)c12.
What is the InChIKey of 2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole?
The InChIKey is AWVZBURAHXAQTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H26N6/c1-39-20-19-37-35(39)28-12-8-14-30-33(28)40(2)34(38-30)24-16-17-27-26-11-3-4-15-31(26)41(32(27)22-24)25-10-7-9-23(21-25)29-13-5-6-18-36-29/h3-22H,1-2H3.
What are the key properties of 2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole?
2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole has a molecular weight of 530.64 g/mol, XLogP of 7.80, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-methyl-7-(1-methylimidazol-2-yl)benzimidazol-2-yl]-9-(3-pyridin-2-ylphenyl)carbazole is sourced from PubChem (CID 142328673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).