4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline

C164H105N9 — CID 157273193

IUPAC4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline
SMILESc1ccc(-c2nc(-c3ccccc3)n(-c3ccc(-c4cc(-c5cccc6ccccc56)c5cc(-c6cccc7ccccc67)c6ccccc6c5n4)cc3)c2-c2ccccc2)cc1.c1ccc(-c2nc3cc(-c4cc(-c5cccc6ccccc56)c5cc(-c6cccc7ccccc67)c6ccccc6c5n4)ccc3n2-c2ccccc2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccc(-c3cc(-c4cccc5ccccc45)c4cc(-c5cccc6ccccc56)c5ccccc5c4n3)cc2)cc1
InChIInChI=1S/C60H39N3.2C52H33N3/c1-4-20-43(21-5-1)57-59(44-22-6-2-7-23-44)63(60(62-57)45-24-8-3-9-25-45)46-36-34-42(35-37-46)56-39-54(50-33-17-27-41-19-11-13-29-48(41)50)55-38-53(51-30-14-15-31-52(51)58(55)61-56)49-32-16-26-40-18-10-12-28-47(40)49;1-3-17-36(18-4-1)52-54-49-31-37(29-30-50(49)55(52)38-21-5-2-6-22-38)48-33-46(42-28-14-20-35-16-8-10-24-40(35)42)47-32-45(43-25-11-12-26-44(43)51(47)53-48)41-27-13-19-34-15-7-9-23-39(34)41;1-2-16-37(17-3-1)52-54-48-26-10-11-27-50(48)55(52)38-30-28-36(29-31-38)49-33-46(42-25-13-19-35-15-5-7-21-40(35)42)47-32-45(43-22-8-9-23-44(43)51(47)53-49)41-24-12-18-34-14-4-6-20-39(34)41/h1-39H;2*1-33H
InChIKeyAYTXFQCLJVRNAN-UHFFFAOYSA-N
MW2201.71 g/mol
LogP43.28
Rot. Bonds17

About 4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline

4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline (PubChem CID 157273193) has the molecular formula C164H105N9 and a molecular weight of 2201.71 g/mol. Its IUPAC name is 4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline.

Molecular Properties

Compound Name4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline
PubChem CID157273193
Molecular FormulaC164H105N9
Molecular Weight2201.71 g/mol
Exact Mass2199.85
IUPAC Name4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline
SMILESc1ccc(-c2nc(-c3ccccc3)n(-c3ccc(-c4cc(-c5cccc6ccccc56)c5cc(-c6cccc7ccccc67)c6ccccc6c5n4)cc3)c2-c2ccccc2)cc1.c1ccc(-c2nc3cc(-c4cc(-c5cccc6ccccc56)c5cc(-c6cccc7ccccc67)c6ccccc6c5n4)ccc3n2-c2ccccc2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccc(-c3cc(-c4cccc5ccccc45)c4cc(-c5cccc6ccccc56)c5ccccc5c4n3)cc2)cc1
InChIInChI=1S/C60H39N3.2C52H33N3/c1-4-20-43(21-5-1)57-59(44-22-6-2-7-23-44)63(60(62-57)45-24-8-3-9-25-45)46-36-34-42(35-37-46)56-39-54(50-33-17-27-41-19-11-13-29-48(41)50)55-38-53(51-30-14-15-31-52(51)58(55)61-56)49-32-16-26-40-18-10-12-28-47(40)49;1-3-17-36(18-4-1)52-54-49-31-37(29-30-50(49)55(52)38-21-5-2-6-22-38)48-33-46(42-28-14-20-35-16-8-10-24-40(35)42)47-32-45(43-25-11-12-26-44(43)51(47)53-48)41-27-13-19-34-15-7-9-23-39(34)41;1-2-16-37(17-3-1)52-54-48-26-10-11-27-50(48)55(52)38-30-28-36(29-31-38)49-33-46(42-25-13-19-35-15-5-7-21-40(35)42)47-32-45(43-22-8-9-23-44(43)51(47)53-49)41-24-12-18-34-14-4-6-20-39(34)41/h1-39H;2*1-33H
InChIKeyAYTXFQCLJVRNAN-UHFFFAOYSA-N
XLogP43.28
TPSA92.13 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds17
Heavy Atoms173
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002201.71
LogP ≤ 543.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze 4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(1,2-diphenylbenzimidazol-5-yl)-2,4-diphenylbenzo[h]quinoline;2,4-diphenyl-6-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline
CID 161113557
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
2,6-dinaphthalen-1-yl-4-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline
CID 70958787
6-(1,2-diphenylbenzimidazol-5-yl)-2,4-diphenylbenzo[h]quinoline
CID 70958976
4-(1,2-diphenylbenzimidazol-5-yl)-2,6-dinaphthalen-2-ylbenzo[h]quinoline
CID 70958695
4-[4-(1-phenylbenzimidazol-2-yl)phenyl]-2,6-bis(4-phenylphenyl)benzo[h]quinoline
CID 70958726
2,6-diphenyl-4-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline
CID 70958763
1-[3-(6,12-dinaphthalen-1-ylchrysen-2-yl)phenyl]-2-phenylbenzimidazole
CID 89280025
1,2-bis(4-naphthalen-1-ylphenyl)benzimidazole
CID 58106321
5-[4-(6-naphthalen-1-yl-9,10-diphenylanthracen-2-yl)phenyl]-1,2-diphenylbenzimidazole
CID 58953645
2-[3,5-bis(4-naphthalen-1-yl-6-phenylpyrimidin-2-yl)phenyl]-1-phenylbenzimidazole
CID 71104991
2-[4-(2,4-diphenylbenzo[h]quinolin-6-yl)phenyl]phenanthro[9,10-d][1,3]oxazole;2,4-diphenyl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]benzo[h]quinoline
CID 161364783

Frequently Asked Questions

What is the IUPAC name of 4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline?
The IUPAC name of 4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline (CID 157273193) is 4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline.
What is the SMILES notation for 4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline?
The canonical SMILES for 4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline is c1ccc(-c2nc(-c3ccccc3)n(-c3ccc(-c4cc(-c5cccc6ccccc56)c5cc(-c6cccc7ccccc67)c6ccccc6c5n4)cc3)c2-c2ccccc2)cc1.c1ccc(-c2nc3cc(-c4cc(-c5cccc6ccccc56)c5cc(-c6cccc7ccccc67)c6ccccc6c5n4)ccc3n2-c2ccccc2)cc1.c1ccc(-c2nc3ccccc3n2-c2ccc(-c3cc(-c4cccc5ccccc45)c4cc(-c5cccc6ccccc56)c5ccccc5c4n3)cc2)cc1.
What is the InChIKey of 4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline?
The InChIKey is AYTXFQCLJVRNAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H39N3.2C52H33N3/c1-4-20-43(21-5-1)57-59(44-22-6-2-7-23-44)63(60(62-57)45-24-8-3-9-25-45)46-36-34-42(35-37-46)56-39-54(50-33-17-27-41-19-11-13-29-48(41)50)55-38-53(51-30-14-15-31-52(51)58(55)61-56)49-32-16-26-40-18-10-12-28-47(40)49;1-3-17-36(18-4-1)52-54-49-31-37(29-30-50(49)55(52)38-21-5-2-6-22-38)48-33-46(42-28-14-20-35-16-8-10-24-40(35)42)47-32-45(43-25-11-12-26-44(43)51(47)53-48)41-27-13-19-34-15-7-9-23-39(34)41;1-2-16-37(17-3-1)52-54-48-26-10-11-27-50(48)55(52)38-30-28-36(29-31-38)49-33-46(42-25-13-19-35-15-5-7-21-40(35)42)47-32-45(43-22-8-9-23-44(43)51(47)53-49)41-24-12-18-34-14-4-6-20-39(34)41/h1-39H;2*1-33H.
What are the key properties of 4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline?
4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline has a molecular weight of 2201.71 g/mol, XLogP of 43.28, 17 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dinaphthalen-1-yl-2-[4-(2-phenylbenzimidazol-1-yl)phenyl]benzo[h]quinoline;4,6-dinaphthalen-1-yl-2-[4-(2,4,5-triphenylimidazol-1-yl)phenyl]benzo[h]quinoline;2-(1,2-diphenylbenzimidazol-5-yl)-4,6-dinaphthalen-1-ylbenzo[h]quinoline is sourced from PubChem (CID 157273193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).