2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol

C53H47N3O2 — CID 154622739

IUPAC2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol
SMILESCCCn1c(-c2cc(C)cc(-c3ccccc3)c2O)c(-c2cccc(-c3c(-c4cc(C)cc(-c5ccccc5)c4O)n(CCC)c4ccccc34)n2)c2ccccc21
InChIInChI=1S/C53H47N3O2/c1-5-28-55-46-26-15-13-22-38(46)48(50(55)42-32-34(3)30-40(52(42)57)36-18-9-7-10-19-36)44-24-17-25-45(54-44)49-39-23-14-16-27-47(39)56(29-6-2)51(49)43-33-35(4)31-41(53(43)58)37-20-11-8-12-21-37/h7-27,30-33,57-58H,5-6,28-29H2,1-4H3
InChIKeyLWEUTOGVPOZXMG-UHFFFAOYSA-N
MW757.98 g/mol
LogP13.84
Rot. Bonds10

About 2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol

2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol (PubChem CID 154622739) has the molecular formula C53H47N3O2 and a molecular weight of 757.98 g/mol. Its IUPAC name is 2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol.

Molecular Properties

Compound Name2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol
PubChem CID154622739
Molecular FormulaC53H47N3O2
Molecular Weight757.98 g/mol
Exact Mass757.37
IUPAC Name2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol
SMILESCCCn1c(-c2cc(C)cc(-c3ccccc3)c2O)c(-c2cccc(-c3c(-c4cc(C)cc(-c5ccccc5)c4O)n(CCC)c4ccccc34)n2)c2ccccc21
InChIInChI=1S/C53H47N3O2/c1-5-28-55-46-26-15-13-22-38(46)48(50(55)42-32-34(3)30-40(52(42)57)36-18-9-7-10-19-36)44-24-17-25-45(54-44)49-39-23-14-16-27-47(39)56(29-6-2)51(49)43-33-35(4)31-41(53(43)58)37-20-11-8-12-21-37/h7-27,30-33,57-58H,5-6,28-29H2,1-4H3
InChIKeyLWEUTOGVPOZXMG-UHFFFAOYSA-N
XLogP13.84
TPSA63.21 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500757.98
LogP ≤ 513.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-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

2-tert-butyl-6-[3-[6-[2-(3-tert-butyl-2-hydroxy-5-methylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methylphenol;carbanide;hafnium
CID 154622745
2-tert-butyl-6-[3-[6-[2-(3-tert-butyl-2-hydroxy-5-methylphenyl)-1-ethylindol-3-yl]-2-pyridinyl]-1-ethylindol-2-yl]-4-methylphenol
CID 154622742
2-tert-butyl-6-[3-[6-[2-(3-tert-butyl-2-hydroxy-5-methylphenyl)-1-phenylindol-3-yl]-2-pyridinyl]-1-phenylindol-2-yl]-4-methylphenol
CID 154622756
2-[2-[6-[2-(3-carbazol-9-yl-2-hydroxy-5-methylphenyl)phenyl]-2-pyridinyl]carbazol-9-yl]-4-methyl-6-phenylphenol
CID 175157618
carbanide;hafnium;2-[2-[6-[2-(2-hydroxy-3-phenylphenyl)phenyl]-2-pyridinyl]phenyl]-6-phenylphenol
CID 154622833
5-(1-propylbenzimidazol-2-yl)benzene-1,3-diol
CID 107704465
(2-methyl-1-propylindol-3-yl)methanol
CID 91556176
2-methyl-4,9-diphenylcarbazole
CID 134488069
5-methyl-2-phenyl-1-propylbenzimidazole
CID 72721451
3-[2-(4,5-diphenyl-1-propylimidazol-2-yl)phenyl]aniline
CID 20577315
carbanide;2-[2-[2-[4-[2-(2-hydroxy-5-methyl-3-phenylphenyl)phenyl]-1,3-thiazol-2-yl]-1,3-thiazol-4-yl]phenyl]-4-methyl-6-phenylphenol;zirconium(2+)
CID 169283759
2-(1-benzyl-2-phenylindol-3-yl)quinoline
CID 101487499

Frequently Asked Questions

What is the IUPAC name of 2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol?
The IUPAC name of 2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol (CID 154622739) is 2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol.
What is the SMILES notation for 2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol?
The canonical SMILES for 2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol is CCCn1c(-c2cc(C)cc(-c3ccccc3)c2O)c(-c2cccc(-c3c(-c4cc(C)cc(-c5ccccc5)c4O)n(CCC)c4ccccc34)n2)c2ccccc21.
What is the InChIKey of 2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol?
The InChIKey is LWEUTOGVPOZXMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H47N3O2/c1-5-28-55-46-26-15-13-22-38(46)48(50(55)42-32-34(3)30-40(52(42)57)36-18-9-7-10-19-36)44-24-17-25-45(54-44)49-39-23-14-16-27-47(39)56(29-6-2)51(49)43-33-35(4)31-41(53(43)58)37-20-11-8-12-21-37/h7-27,30-33,57-58H,5-6,28-29H2,1-4H3.
What are the key properties of 2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol?
2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol has a molecular weight of 757.98 g/mol, XLogP of 13.84, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[6-[2-(2-hydroxy-5-methyl-3-phenylphenyl)-1-propylindol-3-yl]-2-pyridinyl]-1-propylindol-2-yl]-4-methyl-6-phenylphenol is sourced from PubChem (CID 154622739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).