6-(5-dibenzofuran-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-(5-dibenzothiophen-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-[5-(8-phenyldibenzofuran-2-yl)benzo[a]carbazol-11-yl]benzimidazolo[1,2-c]quinazoline

C132H76N12O2S — CID 157344017

About 6-(5-dibenzofuran-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-(5-dibenzothiophen-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-[5-(8-phenyldibenzofuran-2-yl)benzo[a]carbazol-11-yl]benzimidazolo[1,2-c]quinazoline

6-(5-dibenzofuran-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-(5-dibenzothiophen-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-[5-(8-phenyldibenzofuran-2-yl)benzo[a]carbazol-11-yl]benzimidazolo[1,2-c]quinazoline (PubChem CID 157344017) has the molecular formula C132H76N12O2S and a molecular weight of 1894.21 g/mol. Its IUPAC name is 6-(5-dibenzofuran-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-(5-dibenzothiophen-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-[5-(8-phenyldibenzofuran-2-yl)benzo[a]carbazol-11-yl]benzimidazolo[1,2-c]quinazoline.

Molecular Properties

• Compound Name: 6-(5-dibenzofuran-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-(5-dibenzothiophen-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-[5-(8-phenyldibenzofuran-2-yl)benzo[a]carbazol-11-yl]benzimidazolo[1,2-c]quinazoline
• PubChem CID: 157344017
• Molecular Formula: C132H76N12O2S
• Molecular Weight: 1894.21 g/mol
• Exact Mass: 1892.59
• IUPAC Name: 6-(5-dibenzofuran-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-(5-dibenzothiophen-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-[5-(8-phenyldibenzofuran-2-yl)benzo[a]carbazol-11-yl]benzimidazolo[1,2-c]quinazoline
• SMILES: c1ccc(-c2ccc3oc4ccc(-c5cc6c7ccccc7n(-c7nc8ccccc8c8nc9ccccc9n78)c6c6ccccc56)cc4c3c2)cc1.c1ccc2c(c1)nc(-n1c3ccccc3c3cc(-c4cccc5c4oc4ccccc45)c4ccccc4c31)n1c3ccccc3nc21.c1ccc2c(c1)nc(-n1c3ccccc3c3cc(-c4cccc5c4sc4ccccc45)c4ccccc4c31)n1c3ccccc3nc21
• InChI: InChI=1S/C48H28N4O.C42H24N4O.C42H24N4S/c1-2-12-29(13-3-1)30-22-24-44-37(26-30)38-27-31(23-25-45(38)53-44)36-28-39-33-15-7-10-20-42(33)51(46(39)34-16-5-4-14-32(34)36)48-50-40-18-8-6-17-35(40)47-49-41-19-9-11-21-43(41)52(47)48;2*1-2-15-28-25(12-1)32(30-18-11-17-29-27-14-5-10-23-38(27)47-40(29)30)24-33-26-13-4-8-21-36(26)45(39(28)33)42-44-34-19-6-3-16-31(34)41-43-35-20-7-9-22-37(35)46(41)42/h1-28H;2*1-24H
• InChIKey: BGSWUHNCAAFIBM-UHFFFAOYSA-N
• XLogP: 34.69
• TPSA: 131.64 Ų
• H-Bond Acceptors: 15
• Rotatable Bonds: 7
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1894.21
LogP ≤ 5	34.69
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	15

Frequently Asked Questions

What is the IUPAC name of 6-(5-dibenzofuran-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-(5-dibenzothiophen-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-[5-(8-phenyldibenzofuran-2-yl)benzo[a]carbazol-11-yl]benzimidazolo[1,2-c]quinazoline?

The IUPAC name of 6-(5-dibenzofuran-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-(5-dibenzothiophen-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-[5-(8-phenyldibenzofuran-2-yl)benzo[a]carbazol-11-yl]benzimidazolo[1,2-c]quinazoline (CID 157344017) is 6-(5-dibenzofuran-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-(5-dibenzothiophen-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-[5-(8-phenyldibenzofuran-2-yl)benzo[a]carbazol-11-yl]benzimidazolo[1,2-c]quinazoline.

What is the SMILES notation for 6-(5-dibenzofuran-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-(5-dibenzothiophen-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-[5-(8-phenyldibenzofuran-2-yl)benzo[a]carbazol-11-yl]benzimidazolo[1,2-c]quinazoline?

The canonical SMILES for 6-(5-dibenzofuran-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-(5-dibenzothiophen-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-[5-(8-phenyldibenzofuran-2-yl)benzo[a]carbazol-11-yl]benzimidazolo[1,2-c]quinazoline is c1ccc(-c2ccc3oc4ccc(-c5cc6c7ccccc7n(-c7nc8ccccc8c8nc9ccccc9n78)c6c6ccccc56)cc4c3c2)cc1.c1ccc2c(c1)nc(-n1c3ccccc3c3cc(-c4cccc5c4oc4ccccc45)c4ccccc4c31)n1c3ccccc3nc21.c1ccc2c(c1)nc(-n1c3ccccc3c3cc(-c4cccc5c4sc4ccccc45)c4ccccc4c31)n1c3ccccc3nc21.

What is the InChIKey of 6-(5-dibenzofuran-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-(5-dibenzothiophen-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-[5-(8-phenyldibenzofuran-2-yl)benzo[a]carbazol-11-yl]benzimidazolo[1,2-c]quinazoline?

The InChIKey is BGSWUHNCAAFIBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H28N4O.C42H24N4O.C42H24N4S/c1-2-12-29(13-3-1)30-22-24-44-37(26-30)38-27-31(23-25-45(38)53-44)36-28-39-33-15-7-10-20-42(33)51(46(39)34-16-5-4-14-32(34)36)48-50-40-18-8-6-17-35(40)47-49-41-19-9-11-21-43(41)52(47)48;2*1-2-15-28-25(12-1)32(30-18-11-17-29-27-14-5-10-23-38(27)47-40(29)30)24-33-26-13-4-8-21-36(26)45(39(28)33)42-44-34-19-6-3-16-31(34)41-43-35-20-7-9-22-37(35)46(41)42/h1-28H;2*1-24H.

What are the key properties of 6-(5-dibenzofuran-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-(5-dibenzothiophen-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-[5-(8-phenyldibenzofuran-2-yl)benzo[a]carbazol-11-yl]benzimidazolo[1,2-c]quinazoline?

6-(5-dibenzofuran-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-(5-dibenzothiophen-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-[5-(8-phenyldibenzofuran-2-yl)benzo[a]carbazol-11-yl]benzimidazolo[1,2-c]quinazoline has a molecular weight of 1894.21 g/mol, XLogP of 34.69, 7 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(5-dibenzofuran-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-(5-dibenzothiophen-4-ylbenzo[a]carbazol-11-yl)benzimidazolo[1,2-c]quinazoline;6-[5-(8-phenyldibenzofuran-2-yl)benzo[a]carbazol-11-yl]benzimidazolo[1,2-c]quinazoline is sourced from PubChem (CID 157344017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).