2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol

C44H33N3O — CID 169318249

IUPAC2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol
SMILESCc1cccc(C)c1-c1cc(-c2cccc(-c3nc4ccccn4c3-c3ccccc3)c2)nc(-c2ccc(-c3ccccc3)cc2O)c1
InChIInChI=1S/C44H33N3O/c1-29-13-11-14-30(2)42(29)36-26-38(45-39(27-36)37-23-22-33(28-40(37)48)31-15-5-3-6-16-31)34-19-12-20-35(25-34)43-44(32-17-7-4-8-18-32)47-24-10-9-21-41(47)46-43/h3-28,48H,1-2H3
InChIKeyOSCUDKZQRQQCQQ-UHFFFAOYSA-N
MW619.77 g/mol
LogP11.05
Rot. Bonds6

About 2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol

2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol (PubChem CID 169318249) has the molecular formula C44H33N3O and a molecular weight of 619.77 g/mol. Its IUPAC name is 2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol.

Molecular Properties

Compound Name2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol
PubChem CID169318249
Molecular FormulaC44H33N3O
Molecular Weight619.77 g/mol
Exact Mass619.26
IUPAC Name2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol
SMILESCc1cccc(C)c1-c1cc(-c2cccc(-c3nc4ccccn4c3-c3ccccc3)c2)nc(-c2ccc(-c3ccccc3)cc2O)c1
InChIInChI=1S/C44H33N3O/c1-29-13-11-14-30(2)42(29)36-26-38(45-39(27-36)37-23-22-33(28-40(37)48)31-15-5-3-6-16-31)34-19-12-20-35(25-34)43-44(32-17-7-4-8-18-32)47-24-10-9-21-41(47)46-43/h3-28,48H,1-2H3
InChIKeyOSCUDKZQRQQCQQ-UHFFFAOYSA-N
XLogP11.05
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500619.77
LogP ≤ 511.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol 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

5-phenyl-2-[4-phenyl-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]phenol
CID 169318160
2-[4-(2,6-dimethylphenyl)-6-[3-[3-(9-phenylcarbazol-2-yl)imidazo[1,2-a]pyridin-2-yl]phenyl]-2-pyridinyl]phenol
CID 169318136
2-(4-phenylphenyl)-3-[3-[4-phenyl-6-[3-[2-(4-phenylphenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]-2-pyridinyl]phenyl]imidazo[1,2-a]pyridine
CID 164781069
9,9-dimethyl-3-[4-(2-methylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]fluoren-4-ol
CID 169318085
9,9-dimethyl-2-[4-(2-methylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]fluoren-3-ol
CID 169318108
3-phenyl-2-[3-[3-phenyl-5-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]imidazo[1,2-a]pyridine
CID 164781284
2-phenyl-3-[3-[3-phenyl-5-[4-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]phenyl]phenyl]quinoxaline
CID 164781299
3-phenyl-2-[3-[4-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]imidazo[1,2-a]pyridine
CID 168835790
2-phenyl-3-[3-[3-phenyl-5-[4-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]phenyl]phenyl]quinoxaline;2-phenyl-3-[4-[3-phenyl-5-[4-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]phenyl]phenyl]quinoxaline;2-phenyl-3-[3-phenyl-5-[4-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]phenyl]quinoxaline
CID 164994147
2-[3-[3-deuterio-5-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-[3-[3-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]-3-phenylimidazo[1,2-a]pyridine;2-phenyl-3-[3-[3-phenyl-5-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]phenyl]phenyl]quinoxaline
CID 165059818
3-phenyl-2-[4-phenyl-6-[4-phenyl-6-[4-phenyl-6-(3-phenylimidazo[1,2-a]pyridin-2-yl)-2-pyridinyl]-2-pyridinyl]-2-pyridinyl]imidazo[1,2-a]pyridine
CID 155307009
2-phenyl-3-[3-[2-phenyl-6-[3-(2-phenylimidazo[1,2-a]pyridin-3-yl)phenyl]pyrimidin-4-yl]phenyl]imidazo[1,2-a]pyridine
CID 155306963

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol?
The IUPAC name of 2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol (CID 169318249) is 2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol.
What is the SMILES notation for 2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol?
The canonical SMILES for 2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol is Cc1cccc(C)c1-c1cc(-c2cccc(-c3nc4ccccn4c3-c3ccccc3)c2)nc(-c2ccc(-c3ccccc3)cc2O)c1.
What is the InChIKey of 2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol?
The InChIKey is OSCUDKZQRQQCQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H33N3O/c1-29-13-11-14-30(2)42(29)36-26-38(45-39(27-36)37-23-22-33(28-40(37)48)31-15-5-3-6-16-31)34-19-12-20-35(25-34)43-44(32-17-7-4-8-18-32)47-24-10-9-21-41(47)46-43/h3-28,48H,1-2H3.
What are the key properties of 2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol?
2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol has a molecular weight of 619.77 g/mol, XLogP of 11.05, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2,6-dimethylphenyl)-6-[3-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-pyridinyl]-5-phenylphenol is sourced from PubChem (CID 169318249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).