6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole

C50H35N5 — CID 70641108

IUPAC6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole
SMILESC1=CC2=NC(c3ccc(-c4ccc5cc6c(cc5c4)c(-c4ccccc4)c(-c4ccccc4)n6-c4ccc(-c5cn6ccccc6n5)cc4)cc3)CN2C=C1
InChIInChI=1S/C50H35N5/c1-3-11-37(12-4-1)49-43-30-41-29-39(34-17-19-35(20-18-34)44-32-53-27-9-7-15-47(53)51-44)21-22-40(41)31-46(43)55(50(49)38-13-5-2-6-14-38)42-25-23-36(24-26-42)45-33-54-28-10-8-16-48(54)52-45/h1-31,33,44H,32H2
InChIKeyOIWAWUQLZWHKHX-UHFFFAOYSA-N
MW705.87 g/mol
LogP11.94
Rot. Bonds6

About 6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole

6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole (PubChem CID 70641108) has the molecular formula C50H35N5 and a molecular weight of 705.87 g/mol. Its IUPAC name is 6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole.

Molecular Properties

Compound Name6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole
PubChem CID70641108
Molecular FormulaC50H35N5
Molecular Weight705.87 g/mol
Exact Mass705.29
IUPAC Name6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole
SMILESC1=CC2=NC(c3ccc(-c4ccc5cc6c(cc5c4)c(-c4ccccc4)c(-c4ccccc4)n6-c4ccc(-c5cn6ccccc6n5)cc4)cc3)CN2C=C1
InChIInChI=1S/C50H35N5/c1-3-11-37(12-4-1)49-43-30-41-29-39(34-17-19-35(20-18-34)44-32-53-27-9-7-15-47(53)51-44)21-22-40(41)31-46(43)55(50(49)38-13-5-2-6-14-38)42-25-23-36(24-26-42)45-33-54-28-10-8-16-48(54)52-45/h1-31,33,44H,32H2
InChIKeyOIWAWUQLZWHKHX-UHFFFAOYSA-N
XLogP11.94
TPSA37.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500705.87
LogP ≤ 511.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole 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

3-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-9,10-diphenyl-8-[4-(1-phenylbenzimidazol-2-yl)phenyl]naphtho[1,2-f]indole;3-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-9,10-diphenyl-8-[4-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]naphtho[1,2-f]indole;3-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-9,10-diphenyl-8-(6-pyridin-4-yl-2-pyridinyl)naphtho[1,2-f]indole
CID 158195374
2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-imidazo[1,2-a]pyridin-2-yl-9-phenylcarbazole
CID 168835786
1,2,3-triphenylbenzo[f]indole
CID 102138150
1-[4-(3aH-benzimidazol-2-yl)phenyl]-6-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,3-diphenylbenzo[f]indole;6-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,3-diphenyl-1-[4-(1-phenylbenzimidazol-2-yl)phenyl]benzo[f]indole;6-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,3-diphenyl-1-(6-pyridin-4-yl-2-pyridinyl)benzo[f]indole
CID 162061987
7-[4-(2,3-dihydroimidazo[1,2-a]pyrimidin-2-yl)phenyl]-3-(9,9-dimethylfluoren-2-yl)-1,2-diphenylbenzo[e]indole
CID 70641119
3-[4-(5,6-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-6-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-9-phenylcarbazole
CID 67628160
2-[4-[10-[4-[10-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anthracen-9-yl]phenyl]anthracen-9-yl]phenyl]-7-phenylimidazo[1,2-a]pyridine;6-phenyl-2-[4-[10-[4-[10-[4-(6-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]anthracen-9-yl]phenyl]anthracen-9-yl]phenyl]imidazo[1,2-a]pyridine
CID 158282374
N-(4-anthracen-2-ylphenyl)-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)naphthalen-2-amine
CID 165150253
2-[4-[10-[10-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anthracen-9-yl]anthracen-9-yl]phenyl]imidazo[1,2-a]pyridine;2-[4-[10-[10-(4-imidazo[1,2-a]pyridin-2-ylphenyl)anthracen-9-yl]anthracen-9-yl]phenyl]-6-phenylimidazo[1,2-a]pyridine;2-[4-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]phenyl]imidazo[1,2-a]pyridine;2-[4-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[4-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]phenyl]-6-phenylimidazo[1,2-a]pyridine;2-[4-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]phenyl]-7-phenylimidazo[1,2-a]pyridine;3-phenyl-2-[4-[10-[10-[4-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]anthracen-9-yl]anthracen-9-yl]phenyl]imidazo[1,2-a]pyridine
CID 158874452
2-[4-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]phenyl]imidazo[1,2-a]pyridine;2-[4-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[4-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]phenyl]-6-phenylimidazo[1,2-a]pyridine;2-[4-[10-(10-naphthalen-2-ylanthracen-9-yl)anthracen-9-yl]phenyl]-7-phenylimidazo[1,2-a]pyridine
CID 160690482
2-[4-(4-methylphenyl)phenyl]imidazo[1,2-a]pyridine
CID 58880683
11-cyclohepta-1,4,6-trien-1-yl-12-(4-imidazo[1,2-a]pyridin-2-ylphenyl)indolo[2,3-a]carbazole
CID 144549229

Frequently Asked Questions

What is the IUPAC name of 6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole?
The IUPAC name of 6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole (CID 70641108) is 6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole.
What is the SMILES notation for 6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole?
The canonical SMILES for 6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole is C1=CC2=NC(c3ccc(-c4ccc5cc6c(cc5c4)c(-c4ccccc4)c(-c4ccccc4)n6-c4ccc(-c5cn6ccccc6n5)cc4)cc3)CN2C=C1.
What is the InChIKey of 6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole?
The InChIKey is OIWAWUQLZWHKHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H35N5/c1-3-11-37(12-4-1)49-43-30-41-29-39(34-17-19-35(20-18-34)44-32-53-27-9-7-15-47(53)51-44)21-22-40(41)31-46(43)55(50(49)38-13-5-2-6-14-38)42-25-23-36(24-26-42)45-33-54-28-10-8-16-48(54)52-45/h1-31,33,44H,32H2.
What are the key properties of 6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole?
6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole has a molecular weight of 705.87 g/mol, XLogP of 11.94, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(2,3-dihydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-2,3-diphenylbenzo[f]indole is sourced from PubChem (CID 70641108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).