2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium

C202H144AlN13O7Zr — CID 157077777

IUPAC2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium
SMILESC1=Cc2ccc(-c3c4ccccc4c(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)c4ccccc34)cc2CC1.C1=c2c(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)c3ccccc3c(-c3ccc4ccccc4c3)c2=CCC1.Oc1cccc2cccnc12.Oc1cccc2cccnc12.Oc1cccc2cccnc12.Oc1cccc2cccnc12.[Zr].c1ccc(-n2c(-c3ccc(-c4ccc5cc6ccccc6cc5c4)cc3)nc3ccccc32)cc1.c1ccc2ccccc2c1.c1ccc2ccccc2c1.c1cnc2c(O[Al](Oc3cccc4cccnc34)Oc3cccc4cccnc34)cccc2c1
InChIInChI=1S/2C43H30N2.C33H22N2.2C10H8.7C9H7NO.Al.Zr/c1-2-14-34(15-3-1)45-40-21-11-10-20-39(40)44-43(45)31-25-23-30(24-26-31)41-35-16-6-8-18-37(35)42(38-19-9-7-17-36(38)41)33-27-22-29-12-4-5-13-32(29)28-33;1-2-13-31(14-3-1)43-44-39-20-10-11-21-40(39)45(43)34-26-24-30(25-27-34)41-35-16-6-8-18-37(35)42(38-19-9-7-17-36(38)41)33-23-22-29-12-4-5-15-32(29)28-33;1-2-10-30(11-3-1)35-32-13-7-6-12-31(32)34-33(35)24-16-14-23(15-17-24)27-18-19-28-20-25-8-4-5-9-26(25)21-29(28)22-27;2*1-2-6-10-8-4-3-7-9(10)5-1;7*11-8-5-1-3-7-4-2-6-10-9(7)8;;/h1-4,6-12,14-28H,5,13H2;1-6,8,10-28H,7,9H2;1-22H;2*1-8H;7*1-6,11H;;/q;;;;;;;;;;;;+3;/p-3
InChIKeyCHMPVLGSMWKVDU-UHFFFAOYSA-K
MW2983.66 g/mol
LogP48.94
Rot. Bonds17

About 2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium

2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium (PubChem CID 157077777) has the molecular formula C202H144AlN13O7Zr and a molecular weight of 2983.66 g/mol. Its IUPAC name is 2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium.

Molecular Properties

Compound Name2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium
PubChem CID157077777
Molecular FormulaC202H144AlN13O7Zr
Molecular Weight2983.66 g/mol
Exact Mass2980.02
IUPAC Name2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium
SMILESC1=Cc2ccc(-c3c4ccccc4c(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)c4ccccc34)cc2CC1.C1=c2c(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)c3ccccc3c(-c3ccc4ccccc4c3)c2=CCC1.Oc1cccc2cccnc12.Oc1cccc2cccnc12.Oc1cccc2cccnc12.Oc1cccc2cccnc12.[Zr].c1ccc(-n2c(-c3ccc(-c4ccc5cc6ccccc6cc5c4)cc3)nc3ccccc32)cc1.c1ccc2ccccc2c1.c1ccc2ccccc2c1.c1cnc2c(O[Al](Oc3cccc4cccnc34)Oc3cccc4cccnc34)cccc2c1
InChIInChI=1S/2C43H30N2.C33H22N2.2C10H8.7C9H7NO.Al.Zr/c1-2-14-34(15-3-1)45-40-21-11-10-20-39(40)44-43(45)31-25-23-30(24-26-31)41-35-16-6-8-18-37(35)42(38-19-9-7-17-36(38)41)33-27-22-29-12-4-5-13-32(29)28-33;1-2-13-31(14-3-1)43-44-39-20-10-11-21-40(39)45(43)34-26-24-30(25-27-34)41-35-16-6-8-18-37(35)42(38-19-9-7-17-36(38)41)33-23-22-29-12-4-5-15-32(29)28-33;1-2-10-30(11-3-1)35-32-13-7-6-12-31(32)34-33(35)24-16-14-23(15-17-24)27-18-19-28-20-25-8-4-5-9-26(25)21-29(28)22-27;2*1-2-6-10-8-4-3-7-9(10)5-1;7*11-8-5-1-3-7-4-2-6-10-9(7)8;;/h1-4,6-12,14-28H,5,13H2;1-6,8,10-28H,7,9H2;1-22H;2*1-8H;7*1-6,11H;;/q;;;;;;;;;;;;+3;/p-3
InChIKeyCHMPVLGSMWKVDU-UHFFFAOYSA-K
XLogP48.94
TPSA252.30 Ų
H-Bond Donors4
H-Bond Acceptors20
Rotatable Bonds17
Heavy Atoms224
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002983.66
LogP ≤ 548.94
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze 2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium with MolForge

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Related Compounds

4-N,4-N-bis[2,5-dimethyl-4-(N-(3-methylphenyl)anilino)phenyl]-2,5-dimethyl-1-N-(3-methylphenyl)-1-N-phenylbenzene-1,4-diamine;1-[4,6-bis[2-(trifluoromethyl)benzimidazol-1-yl]-1,3,5-triazin-2-yl]-2-(trifluoromethyl)benzimidazole;2,9-dimethyl-4,7-diphenyl-1,10-phenanthroline;tri(quinolin-8-yloxy)alumane
CID 158788116
CID 159204676
CID 159204676
CID 161881947
CID 161881947
2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-(6-tert-butyl-1,1,2,3,3-pentadeuterio-2-phenylinden-5-yl)benzimidazol-2-yl]-5-tert-butylphenol;2-[4-[3-[4-[2,6-bis(2-deuteriopropan-2-yl)phenyl]-2-pyridinyl]-5-tert-butylbenzene-2-id-1-yl]-1-[2-deuterio-1,1,3,3-tetramethyl-2-phenyl-6-(trideuteriomethyl)inden-5-yl]benzimidazol-2-yl]phenol;5-tert-butyl-2-[4-[3-tert-butyl-5-[4-(2-deuterio-1,1,3,3-tetramethyl-2-phenylinden-5-yl)-2-pyridinyl]benzene-6-id-1-yl]-1-(2-phenylphenyl)benzimidazol-2-yl]phenol;platinum;platinum(2+);5,5,7,7-tetrafluoro-3-(1H-naphthalen-1-id-2-yl)-6-phenyl-1-[2-[6-(7-phenyl-3H-naphthalen-3-id-2-yl)-2-pyridinyl]propan-2-yl]-6H-cyclopenta[c]pyridine
CID 163759081
7-[4-[3-Tert-butyl-5-(4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-1-[2,6-di(propan-2-yl)phenyl]-6-(2,2,2-trifluoroethyl)benzimidazol-2-yl]quinolin-8-ol;platinum
CID 177293741
5-[3-[4-(1-Phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-8-ol
CID 89211571
7-[3-[4-(1-Phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-8-ol
CID 89211574
5-[5-[3-(1-Phenylbenzimidazol-2-yl)phenyl]anthracen-1-yl]quinolin-8-ol
CID 89211643
7-[5-[3-(1-Phenylbenzimidazol-2-yl)phenyl]anthracen-1-yl]quinolin-8-ol
CID 89211645
7-[4-[3,5-Bis[4-(6-hydroxy-5-pyrimidin-5-ylindolo[2,3-b]carbazol-7-yl)phenyl]phenyl]phenyl]-5-pyrimidin-5-ylindolo[2,3-b]carbazol-6-ol
CID 132149251
5-[10-(8-Hydroxyquinolin-5-yl)-3-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-8-ol
CID 136502636
5-[2-[4-(1-Phenylbenzimidazol-2-yl)phenyl]anthracen-9-yl]quinolin-8-ol
CID 136502637

Frequently Asked Questions

What is the IUPAC name of 2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium?
The IUPAC name of 2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium (CID 157077777) is 2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium.
What is the SMILES notation for 2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium?
The canonical SMILES for 2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium is C1=Cc2ccc(-c3c4ccccc4c(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)c4ccccc34)cc2CC1.C1=c2c(-c3ccc(-n4c(-c5ccccc5)nc5ccccc54)cc3)c3ccccc3c(-c3ccc4ccccc4c3)c2=CCC1.Oc1cccc2cccnc12.Oc1cccc2cccnc12.Oc1cccc2cccnc12.Oc1cccc2cccnc12.[Zr].c1ccc(-n2c(-c3ccc(-c4ccc5cc6ccccc6cc5c4)cc3)nc3ccccc32)cc1.c1ccc2ccccc2c1.c1ccc2ccccc2c1.c1cnc2c(O[Al](Oc3cccc4cccnc34)Oc3cccc4cccnc34)cccc2c1.
What is the InChIKey of 2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium?
The InChIKey is CHMPVLGSMWKVDU-UHFFFAOYSA-K. The full InChI is InChI=1S/2C43H30N2.C33H22N2.2C10H8.7C9H7NO.Al.Zr/c1-2-14-34(15-3-1)45-40-21-11-10-20-39(40)44-43(45)31-25-23-30(24-26-31)41-35-16-6-8-18-37(35)42(38-19-9-7-17-36(38)41)33-27-22-29-12-4-5-13-32(29)28-33;1-2-13-31(14-3-1)43-44-39-20-10-11-21-40(39)45(43)34-26-24-30(25-27-34)41-35-16-6-8-18-37(35)42(38-19-9-7-17-36(38)41)33-23-22-29-12-4-5-15-32(29)28-33;1-2-10-30(11-3-1)35-32-13-7-6-12-31(32)34-33(35)24-16-14-23(15-17-24)27-18-19-28-20-25-8-4-5-9-26(25)21-29(28)22-27;2*1-2-6-10-8-4-3-7-9(10)5-1;7*11-8-5-1-3-7-4-2-6-10-9(7)8;;/h1-4,6-12,14-28H,5,13H2;1-6,8,10-28H,7,9H2;1-22H;2*1-8H;7*1-6,11H;;/q;;;;;;;;;;;;+3;/p-3.
What are the key properties of 2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium?
2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium has a molecular weight of 2983.66 g/mol, XLogP of 48.94, 17 rotatable bonds, 4 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-anthracen-2-ylphenyl)-1-phenylbenzimidazole;2-[4-[10-(7,8-dihydronaphthalen-2-yl)anthracen-9-yl]phenyl]-1-phenylbenzimidazole;naphthalene;1-[4-(10-naphthalen-2-yl-2,3-dihydroanthracen-9-yl)phenyl]-2-phenylbenzimidazole;tetrakis(quinolin-8-ol);tri(quinolin-8-yloxy)alumane;zirconium is sourced from PubChem (CID 157077777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).