2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole

C43H28N2 — CID 168827448

IUPAC2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole
SMILESc1ccc(-c2ccc3c(-c4nc5ccccc5n4-c4ccccc4)c4cc5ccccc5cc4c(-c4ccccc4)c3c2)cc1
InChIInChI=1S/C43H28N2/c1-4-14-29(15-5-1)33-24-25-35-36(28-33)41(30-16-6-2-7-17-30)37-26-31-18-10-11-19-32(31)27-38(37)42(35)43-44-39-22-12-13-23-40(39)45(43)34-20-8-3-9-21-34/h1-28H
InChIKeyFAZPHAIAOXZYPX-UHFFFAOYSA-N
MW572.71 g/mol
LogP11.49
Rot. Bonds4

About 2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole

2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole (PubChem CID 168827448) has the molecular formula C43H28N2 and a molecular weight of 572.71 g/mol. Its IUPAC name is 2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole.

Molecular Properties

Compound Name2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole
PubChem CID168827448
Molecular FormulaC43H28N2
Molecular Weight572.71 g/mol
Exact Mass572.23
IUPAC Name2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole
SMILESc1ccc(-c2ccc3c(-c4nc5ccccc5n4-c4ccccc4)c4cc5ccccc5cc4c(-c4ccccc4)c3c2)cc1
InChIInChI=1S/C43H28N2/c1-4-14-29(15-5-1)33-24-25-35-36(28-33)41(30-16-6-2-7-17-30)37-26-31-18-10-11-19-32(31)27-38(37)42(35)43-44-39-22-12-13-23-40(39)45(43)34-20-8-3-9-21-34/h1-28H
InChIKeyFAZPHAIAOXZYPX-UHFFFAOYSA-N
XLogP11.49
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500572.71
LogP ≤ 511.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole 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

2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-1-phenylbenzimidazole
CID 20771538
1-phenyl-2-[4-(12-phenyltetracen-5-yl)phenyl]benzimidazole
CID 168827474
1-[4-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenylbenzimidazole
CID 58953815
2-[6-[10-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]naphthalen-2-yl]-1-phenylbenzimidazole
CID 58963543
2-[4-[9,10-dinaphthalen-2-yl-6-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-2-yl]phenyl]-1-phenylbenzimidazole
CID 20771534
2-[3-[10-[6-(9,10-dinaphthalen-2-ylanthracen-2-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]-1-phenylbenzimidazole;2-[4-[10-[6-(9,10-dinaphthalen-2-ylanthracen-2-yl)naphthalen-2-yl]anthracen-9-yl]phenyl]-1-phenylbenzimidazole;2-[6-[10-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]naphthalen-2-yl]-1-phenylbenzimidazole
CID 158746248
2-[10-(2,3,4,5,6-pentadeuteriophenyl)-3-phenylanthracen-9-yl]-1-phenylbenzimidazole
CID 169070172
2-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-1-phenylbenzimidazole;methane
CID 159933758
1-(5,12-diphenyltetracen-2-yl)-2-phenylbenzimidazole
CID 168827455
2-[6-(9,10-dinaphthalen-2-ylanthracen-2-yl)naphthalen-2-yl]-1-phenylbenzimidazole;2-[7-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenanthren-2-yl]-1-phenylbenzimidazole
CID 158004452
1-phenyl-2-[4-[6-[4-(1-phenylbenzimidazol-2-yl)phenyl]-9,10-bis(2-phenylphenyl)anthracen-2-yl]phenyl]benzimidazole
CID 20771522
2-[4-[9,10-bis(naphtho[2,3-b][1]benzofuran-2-yl)anthracen-2-yl]phenyl]-1-phenylbenzimidazole
CID 118503477

Frequently Asked Questions

What is the IUPAC name of 2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole?
The IUPAC name of 2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole (CID 168827448) is 2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole.
What is the SMILES notation for 2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole?
The canonical SMILES for 2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole is c1ccc(-c2ccc3c(-c4nc5ccccc5n4-c4ccccc4)c4cc5ccccc5cc4c(-c4ccccc4)c3c2)cc1.
What is the InChIKey of 2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole?
The InChIKey is FAZPHAIAOXZYPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H28N2/c1-4-14-29(15-5-1)33-24-25-35-36(28-33)41(30-16-6-2-7-17-30)37-26-31-18-10-11-19-32(31)27-38(37)42(35)43-44-39-22-12-13-23-40(39)45(43)34-20-8-3-9-21-34/h1-28H.
What are the key properties of 2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole?
2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole has a molecular weight of 572.71 g/mol, XLogP of 11.49, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,12-diphenyltetracen-5-yl)-1-phenylbenzimidazole is sourced from PubChem (CID 168827448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).