5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine

C48H35N3OSi — CID 162274048

IUPAC5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine
SMILESc1ccc(-c2ccccc2N2CN(c3cccc(Oc4ccc5c(c4)-c4ncccc4[Si]5(c4ccccc4)c4ccccc4)c3)c3ccccc32)cc1
InChIInChI=1S/C48H35N3OSi/c1-4-16-35(17-5-1)41-24-10-11-25-43(41)51-34-50(44-26-12-13-27-45(44)51)36-18-14-19-37(32-36)52-38-29-30-46-42(33-38)48-47(28-15-31-49-48)53(46,39-20-6-2-7-21-39)40-22-8-3-9-23-40/h1-33H,34H2
InChIKeyGOURRSJYHPYGKO-UHFFFAOYSA-N
MW697.91 g/mol
LogP9.15
Rot. Bonds7

About 5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine

5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine (PubChem CID 162274048) has the molecular formula C48H35N3OSi and a molecular weight of 697.91 g/mol. Its IUPAC name is 5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine.

Molecular Properties

Compound Name5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine
PubChem CID162274048
Molecular FormulaC48H35N3OSi
Molecular Weight697.91 g/mol
Exact Mass697.25
IUPAC Name5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine
SMILESc1ccc(-c2ccccc2N2CN(c3cccc(Oc4ccc5c(c4)-c4ncccc4[Si]5(c4ccccc4)c4ccccc4)c3)c3ccccc32)cc1
InChIInChI=1S/C48H35N3OSi/c1-4-16-35(17-5-1)41-24-10-11-25-43(41)51-34-50(44-26-12-13-27-45(44)51)36-18-14-19-37(32-36)52-38-29-30-46-42(33-38)48-47(28-15-31-49-48)53(46,39-20-6-2-7-21-39)40-22-8-3-9-23-40/h1-33H,34H2
InChIKeyGOURRSJYHPYGKO-UHFFFAOYSA-N
XLogP9.15
TPSA28.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500697.91
LogP ≤ 59.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine 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

8-[3-(3-methyl-2H-benzimidazol-1-yl)phenoxy]-5,5-diphenyl-[1]benzosilolo[3,2-b]pyridine
CID 162272328
5,5-diphenyl-8-[3-[3-[2-(2,3,5,6-tetradeuterio-4-methylphenyl)-6-[2,3,5,6-tetradeuterio-4-(trideuteriomethyl)phenyl]phenyl]-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine
CID 162302038
23-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-29-phenyl-18,20-diazaheptacyclo[18.10.1.02,7.08,13.014,19.021,26.027,31]hentriaconta-1(31),2,4,6,8,10,12,14(19),15,17,21(26),22,24,27,29-pentadecaene
CID 171460139
1-pyridin-2-yl-3-[3-[3-[3-[4-[3-[3-[3-(3-pyridin-2-yl-2H-benzimidazol-1-yl)phenoxy]phenyl]-2H-benzimidazol-1-yl]phenyl]-2H-benzimidazol-1-yl]phenoxy]phenyl]-2H-benzimidazole
CID 166007124
9-[4-[3-[3-(2,6-diphenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-2-pyridinyl]carbazole
CID 166007105
9-(4-tert-butyl-2-pyridinyl)-2-[3-[3-(2-phenyl-5,5'-spirobi[benzo[b][1]benzosilole]-1-yl)-2H-benzimidazol-1-yl]phenoxy]carbazole
CID 169065936
1-(2,6-diphenylphenyl)-3-[3-[3-(1-methyl-2H-imidazo[4,5-b]pyridin-3-yl)phenoxy]phenyl]-2H-benzo[e]benzimidazole
CID 164731594
2-[3-(3-phenyl-2H-benzimidazol-1-yl)phenoxy]-9-(4-phenyl-2-pyridinyl)carbazole
CID 167401547
2-[3-[3-methyl-4-(4-methylphenyl)-2H-benzimidazol-1-yl]phenoxy]-9-[4-(2-phenylphenyl)-2-pyridinyl]carbazole
CID 163748784
14,14-diphenyl-12-[3-[3-[2-phenyl-6-(2-phenylphenyl)phenyl]-2H-benzimidazol-1-yl]phenoxy]-9-[4-(trideuteriomethyl)-2-pyridinyl]-9-aza-14-silapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1,3,5,7,10,12,15,17,19-nonaene
CID 177066900
7-[3-[3-(2-tert-butylphenyl)-2H-benzimidazol-1-yl]phenoxy]-5-(4-methyl-5-phenyl-2-pyridinyl)pyrido[2,3-b][1,4]benzotellurazine
CID 168840540
1-[3-[3-[3-[4-[3-[3-[3-(5,6-dimethyl-3-pyridin-4-yl-2H-benzimidazol-1-yl)phenoxy]phenyl]-2H-benzimidazol-1-yl]phenyl]-2H-benzimidazol-1-yl]phenoxy]phenyl]-5,6-dimethyl-3-pyridin-4-yl-2H-benzimidazole
CID 166007130

Frequently Asked Questions

What is the IUPAC name of 5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine?
The IUPAC name of 5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine (CID 162274048) is 5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine.
What is the SMILES notation for 5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine?
The canonical SMILES for 5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine is c1ccc(-c2ccccc2N2CN(c3cccc(Oc4ccc5c(c4)-c4ncccc4[Si]5(c4ccccc4)c4ccccc4)c3)c3ccccc32)cc1.
What is the InChIKey of 5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine?
The InChIKey is GOURRSJYHPYGKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H35N3OSi/c1-4-16-35(17-5-1)41-24-10-11-25-43(41)51-34-50(44-26-12-13-27-45(44)51)36-18-14-19-37(32-36)52-38-29-30-46-42(33-38)48-47(28-15-31-49-48)53(46,39-20-6-2-7-21-39)40-22-8-3-9-23-40/h1-33H,34H2.
What are the key properties of 5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine?
5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine has a molecular weight of 697.91 g/mol, XLogP of 9.15, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-diphenyl-8-[3-[3-(2-phenylphenyl)-2H-benzimidazol-1-yl]phenoxy]-[1]benzosilolo[3,2-b]pyridine is sourced from PubChem (CID 162274048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).