2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole

C188H130N10O5 — CID 157061499

IUPAC2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole
SMILESCC(C)(C)c1cc(-c2cccc3c2oc2ccccc23)ccc1-c1nc2ccccc2n1-c1ccccc1.CC(C)c1cc(-c2cccc3c2oc2ccccc23)ccc1-c1nc2ccccc2n1-c1ccccc1.c1ccc(-c2cc(-c3cccc4c3oc3ccccc34)ccc2-c2nc3ccccc3n2-c2ccccc2)cc1.c1ccc(-n2c(-c3ccc(-c4cccc5c4oc4ccccc45)cc3-c3ccc4ccccc4c3)nc3ccccc32)cc1.c1ccc(-n2c(-c3ccc(-c4cccc5c4oc4ccccc45)cc3-c3cccc4ccccc34)nc3ccccc32)cc1
InChIInChI=1S/2C41H26N2O.C37H24N2O.C35H28N2O.C34H26N2O/c1-2-14-29(15-3-1)43-38-22-8-7-21-37(38)42-41(43)35-25-24-28(26-36(35)32-19-10-13-27-12-4-5-16-30(27)32)31-18-11-20-34-33-17-6-9-23-39(33)44-40(31)34;1-2-13-31(14-3-1)43-38-19-8-7-18-37(38)42-41(43)35-24-23-30(26-36(35)29-22-21-27-11-4-5-12-28(27)25-29)32-16-10-17-34-33-15-6-9-20-39(33)44-40(32)34;1-3-12-25(13-4-1)32-24-26(28-17-11-18-30-29-16-7-10-21-35(29)40-36(28)30)22-23-31(32)37-38-33-19-8-9-20-34(33)39(37)27-14-5-2-6-15-27;1-35(2,3)29-22-23(25-15-11-16-27-26-14-7-10-19-32(26)38-33(25)27)20-21-28(29)34-36-30-17-8-9-18-31(30)37(34)24-12-5-4-6-13-24;1-22(2)29-21-23(25-14-10-15-27-26-13-6-9-18-32(26)37-33(25)27)19-20-28(29)34-35-30-16-7-8-17-31(30)36(34)24-11-4-3-5-12-24/h2*1-26H;1-24H;4-22H,1-3H3;3-22H,1-2H3
InChIKeyABJQADUFAZHCRJ-UHFFFAOYSA-N
MW2609.17 g/mol
LogP51.02
Rot. Bonds19

About 2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole

2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole (PubChem CID 157061499) has the molecular formula C188H130N10O5 and a molecular weight of 2609.17 g/mol. Its IUPAC name is 2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole.

Molecular Properties

Compound Name2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole
PubChem CID157061499
Molecular FormulaC188H130N10O5
Molecular Weight2609.17 g/mol
Exact Mass2607.02
IUPAC Name2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole
SMILESCC(C)(C)c1cc(-c2cccc3c2oc2ccccc23)ccc1-c1nc2ccccc2n1-c1ccccc1.CC(C)c1cc(-c2cccc3c2oc2ccccc23)ccc1-c1nc2ccccc2n1-c1ccccc1.c1ccc(-c2cc(-c3cccc4c3oc3ccccc34)ccc2-c2nc3ccccc3n2-c2ccccc2)cc1.c1ccc(-n2c(-c3ccc(-c4cccc5c4oc4ccccc45)cc3-c3ccc4ccccc4c3)nc3ccccc32)cc1.c1ccc(-n2c(-c3ccc(-c4cccc5c4oc4ccccc45)cc3-c3cccc4ccccc34)nc3ccccc32)cc1
InChIInChI=1S/2C41H26N2O.C37H24N2O.C35H28N2O.C34H26N2O/c1-2-14-29(15-3-1)43-38-22-8-7-21-37(38)42-41(43)35-25-24-28(26-36(35)32-19-10-13-27-12-4-5-16-30(27)32)31-18-11-20-34-33-17-6-9-23-39(33)44-40(31)34;1-2-13-31(14-3-1)43-38-19-8-7-18-37(38)42-41(43)35-24-23-30(26-36(35)29-22-21-27-11-4-5-12-28(27)25-29)32-16-10-17-34-33-15-6-9-20-39(33)44-40(32)34;1-3-12-25(13-4-1)32-24-26(28-17-11-18-30-29-16-7-10-21-35(29)40-36(28)30)22-23-31(32)37-38-33-19-8-9-20-34(33)39(37)27-14-5-2-6-15-27;1-35(2,3)29-22-23(25-15-11-16-27-26-14-7-10-19-32(26)38-33(25)27)20-21-28(29)34-36-30-17-8-9-18-31(30)37(34)24-12-5-4-6-13-24;1-22(2)29-21-23(25-14-10-15-27-26-13-6-9-18-32(26)37-33(25)27)19-20-28(29)34-35-30-16-7-8-17-31(30)36(34)24-11-4-3-5-12-24/h2*1-26H;1-24H;4-22H,1-3H3;3-22H,1-2H3
InChIKeyABJQADUFAZHCRJ-UHFFFAOYSA-N
XLogP51.02
TPSA154.80 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds19
Heavy Atoms203
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002609.17
LogP ≤ 551.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole with MolForge

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Related Compounds

2-[3-[3,3-Bis(1-benzofuran-2-yl)prop-2-enyl]-2-methylbenzimidazol-1-ium-1-yl]-1-naphthalen-2-ylethanone bromide
CID 162655764
2-[3-[3,3-Bis(1-benzofuran-2-yl)prop-2-enyl]benzimidazol-1-ium-1-yl]-1-naphthalen-2-ylethanone bromide
CID 162643142
2-[3-[3,3-Bis(1-benzofuran-2-yl)prop-2-enyl]-2-methylbenzimidazol-1-ium-1-yl]-1-(4-phenylphenyl)ethanone bromide
CID 162652217
1-Naphthalen-2-yl-2-[3-[(2-phenyl-1-benzofuran-3-yl)methyl]benzimidazol-3-ium-1-yl]ethanone bromide
CID 71726676
2-[3-[3,3-Bis(1-benzofuran-2-yl)prop-2-enyl]-5,6-dimethylbenzimidazol-1-ium-1-yl]-1-naphthalen-2-ylethanone bromide
CID 162653771
N-acetyl-N-[4-[4-[5-[2-[8-[2-[2-(3,4-dimethylphenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-11-oxoisoindolo[2,1-a]benzimidazol-8-yl]-11-oxoisoindolo[2,1-a]benzimidazol-2-yl]-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]phenoxy]phenyl]acetamide
CID 57957953
N-acetyl-N-[4-[4-[5-[2-[8-[2-[2-(3,4-dimethylphenyl)-1,1,1-trifluoropropan-2-yl]-11-oxoisoindolo[2,1-a]benzimidazol-8-yl]-11-oxoisoindolo[2,1-a]benzimidazol-2-yl]-1,1,1-trifluoropropan-2-yl]-1,3-dioxoisoindol-2-yl]phenoxy]phenyl]acetamide
CID 58443995
6-(1-Phenylcyclopropyl)-20-[5,5,7,7-tetrafluoro-20-(trifluoromethyl)-6-oxa-1,11-diazapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2(10),3,8,11,13(18),14,16,19-octaen-16-yl]-22-oxa-5,15-diazahexacyclo[17.2.1.02,18.04,16.05,14.08,13]docosa-1(21),2,4(16),6,8,10,12,14,17,19-decaene
CID 123182473
6-Tert-butyl-21-[6-tert-butyl-20-[2-(6-tert-butyl-22-oxa-5,7,15-triazahexacyclo[17.2.1.02,18.04,16.05,14.08,13]docosa-1,3,6,8(13),9,11,14,16,18,20-decaen-10-yl)-2-methylpropyl]-1,9,11,19-tetramethyl-22-oxa-5,7,15-triazahexacyclo[17.2.1.02,18.04,16.05,14.08,13]docosa-2,4(16),6,8(13),9,11,14,17-octaen-10-yl]-3,17-difluoro-22-oxa-5,7,15-triazahexacyclo[17.2.1.02,18.04,16.05,14.08,13]docosa-1,3,6,8,10,12,14,16,18,20-decaene
CID 145697892
2-(1,7-Difluoro-3-methyldibenzofuran-4-yl)-1-(2,6-diphenylphenyl)-3-methylbenzimidazol-3-ium
CID 146764655
2-(7,9-Difluoro-3-methyldibenzofuran-4-yl)-1-methyl-3-phenylbenzimidazol-1-ium
CID 147061718
2-(1,7-Difluoro-3-methyldibenzofuran-4-yl)-1-methyl-3-(2-phenylphenyl)benzimidazol-1-ium
CID 147101258

Frequently Asked Questions

What is the IUPAC name of 2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole?
The IUPAC name of 2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole (CID 157061499) is 2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole.
What is the SMILES notation for 2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole?
The canonical SMILES for 2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole is CC(C)(C)c1cc(-c2cccc3c2oc2ccccc23)ccc1-c1nc2ccccc2n1-c1ccccc1.CC(C)c1cc(-c2cccc3c2oc2ccccc23)ccc1-c1nc2ccccc2n1-c1ccccc1.c1ccc(-c2cc(-c3cccc4c3oc3ccccc34)ccc2-c2nc3ccccc3n2-c2ccccc2)cc1.c1ccc(-n2c(-c3ccc(-c4cccc5c4oc4ccccc45)cc3-c3ccc4ccccc4c3)nc3ccccc32)cc1.c1ccc(-n2c(-c3ccc(-c4cccc5c4oc4ccccc45)cc3-c3cccc4ccccc34)nc3ccccc32)cc1.
What is the InChIKey of 2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole?
The InChIKey is ABJQADUFAZHCRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C41H26N2O.C37H24N2O.C35H28N2O.C34H26N2O/c1-2-14-29(15-3-1)43-38-22-8-7-21-37(38)42-41(43)35-25-24-28(26-36(35)32-19-10-13-27-12-4-5-16-30(27)32)31-18-11-20-34-33-17-6-9-23-39(33)44-40(31)34;1-2-13-31(14-3-1)43-38-19-8-7-18-37(38)42-41(43)35-24-23-30(26-36(35)29-22-21-27-11-4-5-12-28(27)25-29)32-16-10-17-34-33-15-6-9-20-39(33)44-40(32)34;1-3-12-25(13-4-1)32-24-26(28-17-11-18-30-29-16-7-10-21-35(29)40-36(28)30)22-23-31(32)37-38-33-19-8-9-20-34(33)39(37)27-14-5-2-6-15-27;1-35(2,3)29-22-23(25-15-11-16-27-26-14-7-10-19-32(26)38-33(25)27)20-21-28(29)34-36-30-17-8-9-18-31(30)37(34)24-12-5-4-6-13-24;1-22(2)29-21-23(25-14-10-15-27-26-13-6-9-18-32(26)37-33(25)27)19-20-28(29)34-35-30-16-7-8-17-31(30)36(34)24-11-4-3-5-12-24/h2*1-26H;1-24H;4-22H,1-3H3;3-22H,1-2H3.
What are the key properties of 2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole?
2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole has a molecular weight of 2609.17 g/mol, XLogP of 51.02, 19 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-tert-butyl-4-dibenzofuran-4-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-1-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-naphthalen-2-ylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-phenylphenyl)-1-phenylbenzimidazole;2-(4-dibenzofuran-4-yl-2-propan-2-ylphenyl)-1-phenylbenzimidazole is sourced from PubChem (CID 157061499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).