2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole

C204H133F3N8O2 — CID 158295250

IUPAC2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole
SMILESCOc1ccccc1-c1nc2cc(-c3ccccc3)c3ccccc3c2n1-c1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1.FC(F)(F)c1nc2cc(-c3ccccc3)c3ccccc3c2n1-c1ccc(-c2c3ccccc3c(-c3ccccc3-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-n5c(-c6ccccc6)nc6ccc7ccccc7c65)cc4)c4ccccc34)cc2)cc1.c1ccc(Oc2ccc(-c3nc4cc(-c5ccccc5)c5ccccc5c4n3-c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)cc2)cc1
InChIInChI=1S/C55H36N2O.C50H31F3N2.C50H34N2O.C49H32N2/c1-4-16-37(17-5-1)50-36-51-54(49-27-15-10-22-44(49)50)57(55(56-51)40-30-34-43(35-31-40)58-42-20-8-3-9-21-42)41-32-28-39(29-33-41)53-47-25-13-11-23-45(47)52(38-18-6-2-7-19-38)46-24-12-14-26-48(46)53;51-50(52,53)49-54-45-31-44(33-17-5-2-6-18-33)37-20-8-14-26-43(37)48(45)55(49)35-29-27-34(28-30-35)46-39-22-10-12-24-41(39)47(42-25-13-11-23-40(42)46)38-21-9-7-19-36(38)32-15-3-1-4-16-32;1-53-46-27-15-14-26-43(46)50-51-45-32-44(33-16-4-2-5-17-33)37-20-8-13-25-42(37)49(45)52(50)36-30-28-35(29-31-36)48-40-23-11-9-21-38(40)47(34-18-6-3-7-19-34)39-22-10-12-24-41(39)48;1-3-13-33(14-4-1)34-23-25-36(26-24-34)46-41-19-9-11-21-43(41)47(44-22-12-10-20-42(44)46)37-27-30-39(31-28-37)51-48-40-18-8-7-15-35(40)29-32-45(48)50-49(51)38-16-5-2-6-17-38/h1-36H;1-31H;2-32H,1H3;1-32H
InChIKeyGLVIBACETSTVDY-UHFFFAOYSA-N
MW2785.36 g/mol
LogP55.43
Rot. Bonds23

About 2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole

2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole (PubChem CID 158295250) has the molecular formula C204H133F3N8O2 and a molecular weight of 2785.36 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole
PubChem CID158295250
Molecular FormulaC204H133F3N8O2
Molecular Weight2785.36 g/mol
Exact Mass2783.05
IUPAC Name2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole
SMILESCOc1ccccc1-c1nc2cc(-c3ccccc3)c3ccccc3c2n1-c1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1.FC(F)(F)c1nc2cc(-c3ccccc3)c3ccccc3c2n1-c1ccc(-c2c3ccccc3c(-c3ccccc3-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-n5c(-c6ccccc6)nc6ccc7ccccc7c65)cc4)c4ccccc34)cc2)cc1.c1ccc(Oc2ccc(-c3nc4cc(-c5ccccc5)c5ccccc5c4n3-c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)cc2)cc1
InChIInChI=1S/C55H36N2O.C50H31F3N2.C50H34N2O.C49H32N2/c1-4-16-37(17-5-1)50-36-51-54(49-27-15-10-22-44(49)50)57(55(56-51)40-30-34-43(35-31-40)58-42-20-8-3-9-21-42)41-32-28-39(29-33-41)53-47-25-13-11-23-45(47)52(38-18-6-2-7-19-38)46-24-12-14-26-48(46)53;51-50(52,53)49-54-45-31-44(33-17-5-2-6-18-33)37-20-8-14-26-43(37)48(45)55(49)35-29-27-34(28-30-35)46-39-22-10-12-24-41(39)47(42-25-13-11-23-40(42)46)38-21-9-7-19-36(38)32-15-3-1-4-16-32;1-53-46-27-15-14-26-43(46)50-51-45-32-44(33-16-4-2-5-17-33)37-20-8-13-25-42(37)49(45)52(50)36-30-28-35(29-31-36)48-40-23-11-9-21-38(40)47(34-18-6-3-7-19-34)39-22-10-12-24-41(39)48;1-3-13-33(14-4-1)34-23-25-36(26-24-34)46-41-19-9-11-21-43(41)47(44-22-12-10-20-42(44)46)37-27-30-39(31-28-37)51-48-40-18-8-7-15-35(40)29-32-45(48)50-49(51)38-16-5-2-6-17-38/h1-36H;1-31H;2-32H,1H3;1-32H
InChIKeyGLVIBACETSTVDY-UHFFFAOYSA-N
XLogP55.43
TPSA89.74 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds23
Heavy Atoms217
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002785.36
LogP ≤ 555.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

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2-(4-Fluorophenyl)-1-(4-methoxyphenyl)-1H-phenanthro[9,10-d]imidazole
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2,10-Bis(4-methoxyphenyl)-5-[4-(4-methoxyphenyl)phenyl]-3-[3-(trifluoromethyl)phenyl]phenanthro[9,10-d]imidazole
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CID 87281150
17-[2-[(2S,4S)-4-(difluoromethoxymethyl)pyrrolidin-2-yl]-1H-imidazol-5-yl]-6-[(2S,5S)-5-methylpyrrolidin-2-yl]-21-oxa-5,7-diazapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-1(13),2,4(8),5,9,11,14(19),15,17-nonaene
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6-[(4S)-4-(difluoromethoxymethyl)pyrrolidin-2-yl]-17-[2-[(2S,5S)-5-methylpyrrolidin-2-yl]-1H-imidazol-5-yl]-21-oxa-5,7-diazapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-1(13),2,4(8),5,9,11,14(19),15,17-nonaene
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CID 89707521

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole?
The IUPAC name of 2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole (CID 158295250) is 2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole.
What is the SMILES notation for 2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole?
The canonical SMILES for 2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole is COc1ccccc1-c1nc2cc(-c3ccccc3)c3ccccc3c2n1-c1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1.FC(F)(F)c1nc2cc(-c3ccccc3)c3ccccc3c2n1-c1ccc(-c2c3ccccc3c(-c3ccccc3-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-n5c(-c6ccccc6)nc6ccc7ccccc7c65)cc4)c4ccccc34)cc2)cc1.c1ccc(Oc2ccc(-c3nc4cc(-c5ccccc5)c5ccccc5c4n3-c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)cc2)cc1.
What is the InChIKey of 2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole?
The InChIKey is GLVIBACETSTVDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H36N2O.C50H31F3N2.C50H34N2O.C49H32N2/c1-4-16-37(17-5-1)50-36-51-54(49-27-15-10-22-44(49)50)57(55(56-51)40-30-34-43(35-31-40)58-42-20-8-3-9-21-42)41-32-28-39(29-33-41)53-47-25-13-11-23-45(47)52(38-18-6-2-7-19-38)46-24-12-14-26-48(46)53;51-50(52,53)49-54-45-31-44(33-17-5-2-6-18-33)37-20-8-14-26-43(37)48(45)55(49)35-29-27-34(28-30-35)46-39-22-10-12-24-41(39)47(42-25-13-11-23-40(42)46)38-21-9-7-19-36(38)32-15-3-1-4-16-32;1-53-46-27-15-14-26-43(46)50-51-45-32-44(33-16-4-2-5-17-33)37-20-8-13-25-42(37)49(45)52(50)36-30-28-35(29-31-36)48-40-23-11-9-21-38(40)47(34-18-6-3-7-19-34)39-22-10-12-24-41(39)48;1-3-13-33(14-4-1)34-23-25-36(26-24-34)46-41-19-9-11-21-43(41)47(44-22-12-10-20-42(44)46)37-27-30-39(31-28-37)51-48-40-18-8-7-15-35(40)29-32-45(48)50-49(51)38-16-5-2-6-17-38/h1-36H;1-31H;2-32H,1H3;1-32H.
What are the key properties of 2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole?
2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole has a molecular weight of 2785.36 g/mol, XLogP of 55.43, 23 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-(4-phenoxyphenyl)-5-phenyl-1-[4-(10-phenylanthracen-9-yl)phenyl]benzo[e]benzimidazole;2-phenyl-1-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]benzo[e]benzimidazole;5-phenyl-1-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]-2-(trifluoromethyl)benzo[e]benzimidazole is sourced from PubChem (CID 158295250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).