5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole

C146H88N6O3 — CID 162237267

IUPAC5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole
SMILESc1ccc(-c2nc3cc(-c4c5ccccc5c(-c5ccc6oc7cc8ccccc8cc7c6c5)c5ccccc45)ccc3n2-c2ccccc2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccc(-c3c4ccccc4c(-c4ccc5oc6cc7ccccc7cc6c5c4)c4ccccc34)cc2)cc1.c1ccc2cc3c(cc2c1)oc1ccc(-c2c4ccccc4c(-c4ccc(-c5ccc6ccc7cccnc7c6n5)cc4)c4ccccc24)cc13
InChIInChI=1S/2C49H30N2O.C48H28N2O/c1-3-13-31(14-4-1)49-50-43-29-35(23-25-44(43)51(49)36-17-5-2-6-18-36)48-39-21-11-9-19-37(39)47(38-20-10-12-22-40(38)48)34-24-26-45-41(28-34)42-27-32-15-7-8-16-33(32)30-46(42)52-45;1-2-12-32(13-3-1)49-50-43-20-10-11-21-44(43)51(49)36-25-22-31(23-26-36)47-37-16-6-8-18-39(37)48(40-19-9-7-17-38(40)47)35-24-27-45-41(29-35)42-28-33-14-4-5-15-34(33)30-46(42)52-45;1-2-9-34-28-44-41(26-33(34)8-1)40-27-35(22-24-43(40)51-44)46-38-13-5-3-11-36(38)45(37-12-4-6-14-39(37)46)30-17-15-29(16-18-30)42-23-21-32-20-19-31-10-7-25-49-47(31)48(32)50-42/h2*1-30H;1-28H
InChIKeyZWFNOMZXBWEKBO-UHFFFAOYSA-N
MW1974.35 g/mol
LogP39.91
Rot. Bonds11

About 5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole

5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole (PubChem CID 162237267) has the molecular formula C146H88N6O3 and a molecular weight of 1974.35 g/mol. Its IUPAC name is 5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole.

Molecular Properties

Compound Name5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole
PubChem CID162237267
Molecular FormulaC146H88N6O3
Molecular Weight1974.35 g/mol
Exact Mass1972.69
IUPAC Name5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole
SMILESc1ccc(-c2nc3cc(-c4c5ccccc5c(-c5ccc6oc7cc8ccccc8cc7c6c5)c5ccccc45)ccc3n2-c2ccccc2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccc(-c3c4ccccc4c(-c4ccc5oc6cc7ccccc7cc6c5c4)c4ccccc34)cc2)cc1.c1ccc2cc3c(cc2c1)oc1ccc(-c2c4ccccc4c(-c4ccc(-c5ccc6ccc7cccnc7c6n5)cc4)c4ccccc24)cc13
InChIInChI=1S/2C49H30N2O.C48H28N2O/c1-3-13-31(14-4-1)49-50-43-29-35(23-25-44(43)51(49)36-17-5-2-6-18-36)48-39-21-11-9-19-37(39)47(38-20-10-12-22-40(38)48)34-24-26-45-41(28-34)42-27-32-15-7-8-16-33(32)30-46(42)52-45;1-2-12-32(13-3-1)49-50-43-20-10-11-21-44(43)51(49)36-25-22-31(23-26-36)47-37-16-6-8-18-39(37)48(40-19-9-7-17-38(40)47)35-24-27-45-41(29-35)42-28-33-14-4-5-15-34(33)30-46(42)52-45;1-2-9-34-28-44-41(26-33(34)8-1)40-27-35(22-24-43(40)51-44)46-38-13-5-3-11-36(38)45(37-12-4-6-14-39(37)46)30-17-15-29(16-18-30)42-23-21-32-20-19-31-10-7-25-49-47(31)48(32)50-42/h2*1-30H;1-28H
InChIKeyZWFNOMZXBWEKBO-UHFFFAOYSA-N
XLogP39.91
TPSA100.84 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds11
Heavy Atoms155
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001974.35
LogP ≤ 539.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole with MolForge

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Related Compounds

2-[4-[9,10-bis(naphtho[2,3-b][1]benzofuran-2-yl)anthracen-2-yl]phenyl]-1-phenylbenzimidazole
CID 118503477
2-[4-(10-phenylanthracen-9-yl)phenyl]-9-[4-(1-phenylbenzimidazol-2-yl)phenyl]-1,10-phenanthroline
CID 122578272
2-[3-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline
CID 118503436
1-phenyl-2-[4-(12-phenyltetracen-5-yl)phenyl]benzimidazole
CID 168827474
7-[10-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-8-ol
CID 136502686
1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole;2-(10-phenylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;3-(10-phenylanthracen-9-yl)naphtho[2,3-b][1]benzothiole;8-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzothiole;9-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzothiole;2-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,3-b][1]benzothiole;8-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzothiole
CID 158599422
5-[10-[4-(1,10-phenanthrolin-2-yl)phenyl]anthracen-9-yl]-2-phenyl-1,3-benzoxazole
CID 164780534
2-(2,6-diphenyl-4-pyridinyl)-5-(10-naphthalen-2-ylanthracen-9-yl)-1-phenylbenzimidazole
CID 59010716
5-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-7-phenylindolo[2,3-b]carbazole;5-[4-(1,10-phenanthrolin-2-yl)phenyl]-7-phenylindolo[2,3-b]carbazole;7-phenyl-5-[4-(1-phenylbenzimidazol-2-yl)phenyl]indolo[2,3-b]carbazole;7-phenyl-5-[4-(2-phenylbenzimidazol-1-yl)phenyl]indolo[2,3-b]carbazole
CID 161320232
2-methyl-1-[4-(10-naphtho[2,3-b][1]benzofuran-3-ylanthracen-9-yl)phenyl]benzimidazole
CID 134487962
2-(1,2-diphenylbenzimidazol-5-yl)-4,6-diphenylbenzo[h]quinoline;4,6-diphenyl-2-[4-(1-phenylbenzimidazol-2-yl)phenyl]benzo[h]quinoline;4,6-diphenyl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline
CID 158321652
2-[10-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]-5H-benzo[b]carbazole
CID 163742367

Frequently Asked Questions

What is the IUPAC name of 5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole?
The IUPAC name of 5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole (CID 162237267) is 5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole.
What is the SMILES notation for 5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole?
The canonical SMILES for 5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole is c1ccc(-c2nc3cc(-c4c5ccccc5c(-c5ccc6oc7cc8ccccc8cc7c6c5)c5ccccc45)ccc3n2-c2ccccc2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccc(-c3c4ccccc4c(-c4ccc5oc6cc7ccccc7cc6c5c4)c4ccccc34)cc2)cc1.c1ccc2cc3c(cc2c1)oc1ccc(-c2c4ccccc4c(-c4ccc(-c5ccc6ccc7cccnc7c6n5)cc4)c4ccccc24)cc13.
What is the InChIKey of 5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole?
The InChIKey is ZWFNOMZXBWEKBO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C49H30N2O.C48H28N2O/c1-3-13-31(14-4-1)49-50-43-29-35(23-25-44(43)51(49)36-17-5-2-6-18-36)48-39-21-11-9-19-37(39)47(38-20-10-12-22-40(38)48)34-24-26-45-41(28-34)42-27-32-15-7-8-16-33(32)30-46(42)52-45;1-2-12-32(13-3-1)49-50-43-20-10-11-21-44(43)51(49)36-25-22-31(23-26-36)47-37-16-6-8-18-39(37)48(40-19-9-7-17-38(40)47)35-24-27-45-41(29-35)42-28-33-14-4-5-15-34(33)30-46(42)52-45;1-2-9-34-28-44-41(26-33(34)8-1)40-27-35(22-24-43(40)51-44)46-38-13-5-3-11-36(38)45(37-12-4-6-14-39(37)46)30-17-15-29(16-18-30)42-23-21-32-20-19-31-10-7-25-49-47(31)48(32)50-42/h2*1-30H;1-28H.
What are the key properties of 5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole?
5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole has a molecular weight of 1974.35 g/mol, XLogP of 39.91, 11 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)-1,2-diphenylbenzimidazole;2-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-1,10-phenanthroline;1-[4-(10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)phenyl]-2-phenylbenzimidazole is sourced from PubChem (CID 162237267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).