8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole

C156H106N10O — CID 161112184

IUPAC8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole
SMILESC1=C(c2ccc3ccccc3c2)C=C(c2ccc3ccccc3c2)C2Nc3c(-c4ccc(-c5cccnc5)cc4)cc(-c4ccccc4-c4ccccc4)cc3N12.C1=C(c2ccccc2)C=C(c2ccccc2)C2Nc3c(-c4cccc(-c5cccnc5)c4)cc(-c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3N12.C1=CC2Nc3c(-c4ccc(-c5cncc6ccccc56)cc4)cc(-c4ccccc4)cc3N2C=C1c1ccc2c(c1)c1ccccc1n2-c1ccccc1
InChIInChI=1S/C54H37N3.C52H35N3O.C50H34N4/c1-2-13-39(14-3-1)48-18-8-9-19-49(48)46-31-50(40-24-20-38(21-25-40)45-17-10-28-55-34-45)53-52(33-46)57-35-47(43-26-22-36-11-4-6-15-41(36)29-43)32-51(54(57)56-53)44-27-23-37-12-5-7-16-42(37)30-44;1-3-12-34(13-4-1)42-30-47(36-14-5-2-6-15-36)52-54-50-46(39-17-9-16-38(28-39)40-18-11-27-53-32-40)29-41(31-48(50)55(52)33-42)35-23-25-37(26-24-35)43-20-10-21-45-44-19-7-8-22-49(44)56-51(43)45;1-3-11-33(12-4-1)39-28-43(34-19-21-35(22-20-34)45-31-51-30-37-13-7-8-16-41(37)45)50-48(29-39)53-32-38(24-26-49(53)52-50)36-23-25-47-44(27-36)42-17-9-10-18-46(42)54(47)40-14-5-2-6-15-40/h1-35,54,56H;1-33,52,54H;1-32,49,52H
InChIKeyUJVLHNTYQJNDTQ-UHFFFAOYSA-N
MW2136.63 g/mol
LogP39.60
Rot. Bonds17

About 8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole

8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole (PubChem CID 161112184) has the molecular formula C156H106N10O and a molecular weight of 2136.63 g/mol. Its IUPAC name is 8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole.

Molecular Properties

Compound Name8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole
PubChem CID161112184
Molecular FormulaC156H106N10O
Molecular Weight2136.63 g/mol
Exact Mass2134.86
IUPAC Name8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole
SMILESC1=C(c2ccc3ccccc3c2)C=C(c2ccc3ccccc3c2)C2Nc3c(-c4ccc(-c5cccnc5)cc4)cc(-c4ccccc4-c4ccccc4)cc3N12.C1=C(c2ccccc2)C=C(c2ccccc2)C2Nc3c(-c4cccc(-c5cccnc5)c4)cc(-c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3N12.C1=CC2Nc3c(-c4ccc(-c5cncc6ccccc56)cc4)cc(-c4ccccc4)cc3N2C=C1c1ccc2c(c1)c1ccccc1n2-c1ccccc1
InChIInChI=1S/C54H37N3.C52H35N3O.C50H34N4/c1-2-13-39(14-3-1)48-18-8-9-19-49(48)46-31-50(40-24-20-38(21-25-40)45-17-10-28-55-34-45)53-52(33-46)57-35-47(43-26-22-36-11-4-6-15-41(36)29-43)32-51(54(57)56-53)44-27-23-37-12-5-7-16-42(37)30-44;1-3-12-34(13-4-1)42-30-47(36-14-5-2-6-15-36)52-54-50-46(39-17-9-16-38(28-39)40-18-11-27-53-32-40)29-41(31-48(50)55(52)33-42)35-23-25-37(26-24-35)43-20-10-21-45-44-19-7-8-22-49(44)56-51(43)45;1-3-11-33(12-4-1)39-28-43(34-19-21-35(22-20-34)45-31-51-30-37-13-7-8-16-41(37)45)50-48(29-39)53-32-38(24-26-49(53)52-50)36-23-25-47-44(27-36)42-17-9-10-18-46(42)54(47)40-14-5-2-6-15-40/h1-35,54,56H;1-33,52,54H;1-32,49,52H
InChIKeyUJVLHNTYQJNDTQ-UHFFFAOYSA-N
XLogP39.60
TPSA102.55 Ų
H-Bond Donors3
H-Bond Acceptors11
Rotatable Bonds17
Heavy Atoms167
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002136.63
LogP ≤ 539.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1011

Analyze 8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole with MolForge

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Related Compounds

6-(4-carbazol-9-ylphenyl)-2-dibenzofuran-4-yl-9-(4-naphthalen-2-ylphenyl)carbazole
CID 126682058
3-dibenzofuran-4-yl-9-[4-[2-phenyl-6-(4-pyridin-3-ylphenyl)pyrimidin-4-yl]phenyl]carbazole
CID 121422970
3-dibenzofuran-4-yl-9-(3,5-dinaphthalen-2-ylphenyl)carbazole
CID 142356877
3-[3-[3-(4-dibenzofuran-4-ylphenyl)phenyl]phenyl]-9-phenylcarbazole
CID 121262432
5-(4-dibenzofuran-4-ylphenyl)-2,11-diphenylindolo[3,2-b]carbazole;5-(4-dibenzofuran-4-ylphenyl)-3,11-diphenylindolo[3,2-b]carbazole;5-(4-dibenzofuran-4-ylphenyl)-11-naphthalen-2-ylindolo[3,2-b]carbazole
CID 159976213
3-[3-[10-(3-dibenzofuran-4-ylphenyl)anthracen-9-yl]phenyl]-9-phenylcarbazole;3-[3-[10-(4-dibenzofuran-4-ylphenyl)anthracen-9-yl]phenyl]-9-phenylcarbazole;2-[3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene;2-[3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene;2-[4-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene
CID 161110671
3-dibenzofuran-2-yl-6-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-3-yl-6-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-dibenzofuran-4-yl-6-[9-(4-naphthalen-2-ylphenyl)carbazol-3-yl]-9-phenylcarbazole
CID 163485111
2-dibenzofuran-4-yl-5-[3-(5-phenylbenzo[b]carbazol-8-yl)quinoxalin-2-yl]benzo[b]carbazole
CID 147851338
N-[4-[4-[3-dibenzofuran-4-yl-5-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 121443649
3-[9-(3-dibenzofuran-4-ylphenyl)carbazol-3-yl]-9-naphthalen-2-ylcarbazole
CID 155305912
9-[3-[10-(3-dibenzofuran-4-ylphenyl)anthracen-9-yl]phenyl]carbazole;9,10-dinaphthalen-2-ylanthracene
CID 159084891
2-[3-dibenzofuran-4-yl-5-(3-phenylphenyl)phenyl]-9-phenylcarbazole
CID 122492294

Frequently Asked Questions

What is the IUPAC name of 8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole?
The IUPAC name of 8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole (CID 161112184) is 8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole.
What is the SMILES notation for 8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole?
The canonical SMILES for 8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole is C1=C(c2ccc3ccccc3c2)C=C(c2ccc3ccccc3c2)C2Nc3c(-c4ccc(-c5cccnc5)cc4)cc(-c4ccccc4-c4ccccc4)cc3N12.C1=C(c2ccccc2)C=C(c2ccccc2)C2Nc3c(-c4cccc(-c5cccnc5)c4)cc(-c4ccc(-c5cccc6c5oc5ccccc56)cc4)cc3N12.C1=CC2Nc3c(-c4ccc(-c5cncc6ccccc56)cc4)cc(-c4ccccc4)cc3N2C=C1c1ccc2c(c1)c1ccccc1n2-c1ccccc1.
What is the InChIKey of 8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole?
The InChIKey is UJVLHNTYQJNDTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H37N3.C52H35N3O.C50H34N4/c1-2-13-39(14-3-1)48-18-8-9-19-49(48)46-31-50(40-24-20-38(21-25-40)45-17-10-28-55-34-45)53-52(33-46)57-35-47(43-26-22-36-11-4-6-15-41(36)29-43)32-51(54(57)56-53)44-27-23-37-12-5-7-16-42(37)30-44;1-3-12-34(13-4-1)42-30-47(36-14-5-2-6-15-36)52-54-50-46(39-17-9-16-38(28-39)40-18-11-27-53-32-40)29-41(31-48(50)55(52)33-42)35-23-25-37(26-24-35)43-20-10-21-45-44-19-7-8-22-49(44)56-51(43)45;1-3-11-33(12-4-1)39-28-43(34-19-21-35(22-20-34)45-31-51-30-37-13-7-8-16-41(37)45)50-48(29-39)53-32-38(24-26-49(53)52-50)36-23-25-47-44(27-36)42-17-9-10-18-46(42)54(47)40-14-5-2-6-15-40/h1-35,54,56H;1-33,52,54H;1-32,49,52H.
What are the key properties of 8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole?
8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole has a molecular weight of 2136.63 g/mol, XLogP of 39.60, 17 rotatable bonds, 3 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-dibenzofuran-4-ylphenyl)-2,4-diphenyl-6-(3-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;2,4-dinaphthalen-2-yl-8-(2-phenylphenyl)-6-(4-pyridin-3-ylphenyl)-4a,5-dihydropyrido[1,2-a]benzimidazole;6-(4-isoquinolin-4-ylphenyl)-8-phenyl-2-(9-phenylcarbazol-3-yl)-4a,5-dihydropyrido[1,2-a]benzimidazole is sourced from PubChem (CID 161112184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).