1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole

C136H92N20 — CID 161074614

IUPAC1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole
SMILESc1ccc(-c2nc3ccccc3n2-c2ccccc2-c2ccc(-n3cnc4ccccc43)c(-n3cnc4ccccc43)c2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccccc2-c2ccccc2-n2c(-c3ccccc3)nc3ccccc32)cc1.c1ccc(-n2cnc3ccccc32)c(-c2ccc(-n3cnc4ccccc43)c(-n3cnc4ccccc43)c2)c1.c1ccc(-n2cnc3ccccc32)c(-c2ccccc2-n2cnc3ccccc32)c1
InChIInChI=1S/C39H26N6.C38H26N4.C33H22N6.C26H18N4/c1-2-12-27(13-3-1)39-42-32-17-7-11-21-36(32)45(39)33-18-8-4-14-29(33)28-22-23-37(43-25-40-30-15-5-9-19-34(30)43)38(24-28)44-26-41-31-16-6-10-20-35(31)44;1-3-15-27(16-4-1)37-39-31-21-9-13-25-35(31)41(37)33-23-11-7-19-29(33)30-20-8-12-24-34(30)42-36-26-14-10-22-32(36)40-38(42)28-17-5-2-6-18-28;1-5-13-28(37-20-34-25-10-2-6-14-29(25)37)24(9-1)23-17-18-32(38-21-35-26-11-3-7-15-30(26)38)33(19-23)39-22-36-27-12-4-8-16-31(27)39;1-5-13-23(29-17-27-21-11-3-7-15-25(21)29)19(9-1)20-10-2-6-14-24(20)30-18-28-22-12-4-8-16-26(22)30/h1-26H;1-26H;1-22H;1-18H
InChIKeyUFCHIWSQKZLJJS-UHFFFAOYSA-N
MW2006.37 g/mol
LogP31.80
Rot. Bonds17

About 1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole

1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole (PubChem CID 161074614) has the molecular formula C136H92N20 and a molecular weight of 2006.37 g/mol. Its IUPAC name is 1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole.

Molecular Properties

Compound Name1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole
PubChem CID161074614
Molecular FormulaC136H92N20
Molecular Weight2006.37 g/mol
Exact Mass2004.78
IUPAC Name1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole
SMILESc1ccc(-c2nc3ccccc3n2-c2ccccc2-c2ccc(-n3cnc4ccccc43)c(-n3cnc4ccccc43)c2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccccc2-c2ccccc2-n2c(-c3ccccc3)nc3ccccc32)cc1.c1ccc(-n2cnc3ccccc32)c(-c2ccc(-n3cnc4ccccc43)c(-n3cnc4ccccc43)c2)c1.c1ccc(-n2cnc3ccccc32)c(-c2ccccc2-n2cnc3ccccc32)c1
InChIInChI=1S/C39H26N6.C38H26N4.C33H22N6.C26H18N4/c1-2-12-27(13-3-1)39-42-32-17-7-11-21-36(32)45(39)33-18-8-4-14-29(33)28-22-23-37(43-25-40-30-15-5-9-19-34(30)43)38(24-28)44-26-41-31-16-6-10-20-35(31)44;1-3-15-27(16-4-1)37-39-31-21-9-13-25-35(31)41(37)33-23-11-7-19-29(33)30-20-8-12-24-34(30)42-36-26-14-10-22-32(36)40-38(42)28-17-5-2-6-18-28;1-5-13-28(37-20-34-25-10-2-6-14-29(25)37)24(9-1)23-17-18-32(38-21-35-26-11-3-7-15-30(26)38)33(19-23)39-22-36-27-12-4-8-16-31(27)39;1-5-13-23(29-17-27-21-11-3-7-15-25(21)29)19(9-1)20-10-2-6-14-24(20)30-18-28-22-12-4-8-16-26(22)30/h1-26H;1-26H;1-22H;1-18H
InChIKeyUFCHIWSQKZLJJS-UHFFFAOYSA-N
XLogP31.80
TPSA178.20 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds17
Heavy Atoms156
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002006.37
LogP ≤ 531.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze 1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole with MolForge

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Related Compounds

1-[2-[9,10-diphenyl-6-[2-(2-phenylbenzimidazol-1-yl)phenyl]anthracen-2-yl]phenyl]-2-phenylbenzimidazole
CID 58953786
1-[3-[2-(benzimidazol-1-yl)phenyl]-5-(2-phenylbenzimidazol-1-yl)phenyl]-2-phenylbenzimidazole;1-[2-[3,5-bis(benzimidazol-1-yl)phenyl]phenyl]-2-methylbenzimidazole;1-[2-[3,5-bis(benzimidazol-1-yl)phenyl]phenyl]-2-pyridin-2-ylbenzimidazole;1-[2-[3,5-bis(2-phenylbenzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole
CID 157405801
1-[4-[2-[3-(benzimidazol-1-yl)phenyl]phenyl]phenyl]-2-phenylbenzimidazole;1-[2-[3,5-bis(benzimidazol-1-yl)phenyl]-3-(2-phenylbenzimidazol-1-yl)phenyl]-2-phenylbenzimidazole;1-[3-[2,6-bis(benzimidazol-1-yl)phenyl]-5-(2-phenylbenzimidazol-1-yl)phenyl]-2-phenylbenzimidazole;2-phenyl-1-[3-[2-[4-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]phenyl]benzimidazole
CID 159476548
1,5-dimethyl-2-phenylbenzimidazole;2-phenyl-1-(2-phenylphenyl)benzimidazole
CID 143996079
2-phenyl-1-[2-[4-[2-(2-phenylbenzimidazol-1-yl)phenyl]-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]benzimidazole
CID 155186007
1-[2-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole
CID 166509851
1-(2-methylphenyl)-2-phenylbenzimidazole
CID 59359524
1-[4-bromo-2-(2-phenylbenzimidazol-1-yl)phenyl]-2-phenylbenzimidazole
CID 141480526
2-(3,5-difluorophenyl)-1-[2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]benzimidazole
CID 155173901
1-[2-[4,6-bis(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]phenyl]-2-phenylbenzimidazole
CID 176879180
1-[10-naphthalen-1-yl-8-(2-phenylbenzimidazol-1-yl)anthracen-1-yl]-2-phenylbenzimidazole
CID 148932878
1-[2-(10-dibenzothiophen-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole
CID 170236710

Frequently Asked Questions

What is the IUPAC name of 1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole?
The IUPAC name of 1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole (CID 161074614) is 1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole.
What is the SMILES notation for 1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole?
The canonical SMILES for 1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole is c1ccc(-c2nc3ccccc3n2-c2ccccc2-c2ccc(-n3cnc4ccccc43)c(-n3cnc4ccccc43)c2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccccc2-c2ccccc2-n2c(-c3ccccc3)nc3ccccc32)cc1.c1ccc(-n2cnc3ccccc32)c(-c2ccc(-n3cnc4ccccc43)c(-n3cnc4ccccc43)c2)c1.c1ccc(-n2cnc3ccccc32)c(-c2ccccc2-n2cnc3ccccc32)c1.
What is the InChIKey of 1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole?
The InChIKey is UFCHIWSQKZLJJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H26N6.C38H26N4.C33H22N6.C26H18N4/c1-2-12-27(13-3-1)39-42-32-17-7-11-21-36(32)45(39)33-18-8-4-14-29(33)28-22-23-37(43-25-40-30-15-5-9-19-34(30)43)38(24-28)44-26-41-31-16-6-10-20-35(31)44;1-3-15-27(16-4-1)37-39-31-21-9-13-25-35(31)41(37)33-23-11-7-19-29(33)30-20-8-12-24-34(30)42-36-26-14-10-22-32(36)40-38(42)28-17-5-2-6-18-28;1-5-13-28(37-20-34-25-10-2-6-14-29(25)37)24(9-1)23-17-18-32(38-21-35-26-11-3-7-15-30(26)38)33(19-23)39-22-36-27-12-4-8-16-31(27)39;1-5-13-23(29-17-27-21-11-3-7-15-25(21)29)19(9-1)20-10-2-6-14-24(20)30-18-28-22-12-4-8-16-26(22)30/h1-26H;1-26H;1-22H;1-18H.
What are the key properties of 1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole?
1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole has a molecular weight of 2006.37 g/mol, XLogP of 31.80, 17 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(benzimidazol-1-yl)-4-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[2-(benzimidazol-1-yl)phenyl]phenyl]benzimidazole;1-[2-[3,4-bis(benzimidazol-1-yl)phenyl]phenyl]-2-phenylbenzimidazole;2-phenyl-1-[2-[2-(2-phenylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole is sourced from PubChem (CID 161074614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).