2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine

C132H92N6O3SSi3 — CID 159052658

IUPAC2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine
SMILESC[Si]1(C)c2ccccc2-c2nc(-c3cccc4c3oc3ccccc34)nc(-c3cccc4c3oc3ccccc34)c21.C[Si]1(C)c2ccccc2-c2nc(-c3cccc4oc5ccccc5c34)nc(-c3cccc(-c4cccc(-c5ccc(-c6ccccc6)cc5)c4)c3)c21.C[Si]1(C)c2ccccc2-c2nc(-c3cccc4sc5ccccc5c34)nc(-c3cccc(-c4cccc(-c5ccc(-c6ccccc6)cc5)c4)c3)c21
InChIInChI=1S/C48H34N2OSi.C48H34N2SSi.C36H24N2O2Si/c2*1-52(2)43-24-9-7-20-39(43)46-47(52)45(49-48(50-46)40-21-12-23-42-44(40)38-19-6-8-22-41(38)51-42)37-18-11-17-36(30-37)35-16-10-15-34(29-35)33-27-25-32(26-28-33)31-13-4-3-5-14-31;1-41(2)30-20-8-5-13-25(30)31-35(41)32(26-16-9-14-23-21-11-3-6-18-28(21)39-33(23)26)38-36(37-31)27-17-10-15-24-22-12-4-7-19-29(22)40-34(24)27/h2*3-30H,1-2H3;3-20H,1-2H3
InChIKeyJXLRXUWCOIDLNC-UHFFFAOYSA-N
MW1926.55 g/mol
LogP31.91
Rot. Bonds12

About 2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine

2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine (PubChem CID 159052658) has the molecular formula C132H92N6O3SSi3 and a molecular weight of 1926.55 g/mol. Its IUPAC name is 2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine.

Molecular Properties

Compound Name2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine
PubChem CID159052658
Molecular FormulaC132H92N6O3SSi3
Molecular Weight1926.55 g/mol
Exact Mass1924.63
IUPAC Name2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine
SMILESC[Si]1(C)c2ccccc2-c2nc(-c3cccc4c3oc3ccccc34)nc(-c3cccc4c3oc3ccccc34)c21.C[Si]1(C)c2ccccc2-c2nc(-c3cccc4oc5ccccc5c34)nc(-c3cccc(-c4cccc(-c5ccc(-c6ccccc6)cc5)c4)c3)c21.C[Si]1(C)c2ccccc2-c2nc(-c3cccc4sc5ccccc5c34)nc(-c3cccc(-c4cccc(-c5ccc(-c6ccccc6)cc5)c4)c3)c21
InChIInChI=1S/C48H34N2OSi.C48H34N2SSi.C36H24N2O2Si/c2*1-52(2)43-24-9-7-20-39(43)46-47(52)45(49-48(50-46)40-21-12-23-42-44(40)38-19-6-8-22-41(38)51-42)37-18-11-17-36(30-37)35-16-10-15-34(29-35)33-27-25-32(26-28-33)31-13-4-3-5-14-31;1-41(2)30-20-8-5-13-25(30)31-35(41)32(26-16-9-14-23-21-11-3-6-18-28(21)39-33(23)26)38-36(37-31)27-17-10-15-24-22-12-4-7-19-29(22)40-34(24)27/h2*3-30H,1-2H3;3-20H,1-2H3
InChIKeyJXLRXUWCOIDLNC-UHFFFAOYSA-N
XLogP31.91
TPSA116.76 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds12
Heavy Atoms145
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001926.55
LogP ≤ 531.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze 2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine 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-(3-dibenzofuran-4-ylphenyl)-5,5-dimethyl-4-[3-(3-phenylphenyl)phenyl]-[1]benzosilolo[3,2-d]pyrimidine
CID 154010464
2-dibenzofuran-4-yl-4-dibenzothiophen-1-yl-6-(6-phenylnaphthalen-2-yl)-1,3,5-triazine
CID 163883122
2-(4-dibenzofuran-4-ylphenyl)-4-phenyl-6-[8-(3-phenylphenyl)dibenzothiophen-1-yl]-1,3,5-triazine
CID 139548908
2-dibenzofuran-4-yl-4-phenyl-6-[8-[3-(2-phenylphenyl)phenyl]dibenzothiophen-1-yl]-1,3,5-triazine
CID 134198584
4-dibenzofuran-4-yl-9,9-dimethyl-2-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[2,3-d]pyrimidine;4-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-2-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[2,3-d]pyrimidine;2-[3-(3-dibenzothiophen-4-ylphenyl)phenyl]-9,9-dimethyl-4-phenyl-[1]benzosilolo[2,3-d]pyrimidine
CID 158862428
2-dibenzofuran-4-yl-4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-2-yl]-6-phenyl-1,3,5-triazine
CID 155050381
2-(1-dibenzothiophen-1-yldibenzofuran-4-yl)-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
CID 155078795
2-(2-dibenzofuran-1-ylphenyl)-4-phenyl-6-[8-[3-(3-phenylphenyl)phenyl]dibenzothiophen-1-yl]-1,3,5-triazine;2-(3-dibenzofuran-4-ylphenyl)-4-phenyl-6-[8-[3-(4-phenylphenyl)phenyl]dibenzothiophen-1-yl]-1,3,5-triazine;2-(4-dibenzofuran-3-ylphenyl)-4-phenyl-6-[8-[3-(4-phenylphenyl)phenyl]dibenzothiophen-1-yl]-1,3,5-triazine;2-(3-dibenzothiophen-2-ylphenyl)-4-phenyl-6-[8-[2-(2-phenylphenyl)phenyl]dibenzothiophen-1-yl]-1,3,5-triazine;2-(4-dibenzothiophen-1-ylphenyl)-4-phenyl-6-[8-[2-(2-phenylphenyl)phenyl]dibenzothiophen-1-yl]-1,3,5-triazine
CID 159756068
2-[3-(3-dibenzofuran-4-ylphenyl)phenyl]-4-(3-phenylphenyl)-[1]benzothiolo[2,3-d]pyrimidine
CID 134253007
2-dibenzofuran-4-yl-4-(7-dibenzothiophen-1-yldibenzofuran-1-yl)-6-naphthalen-2-yl-1,3,5-triazine
CID 166741560
4-[3-(3,5-diphenylphenyl)phenyl]-5,5-dimethyl-2-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine
CID 140763959
2-dibenzofuran-1-yl-4-phenyl-6-[9-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]dibenzothiophen-3-yl]-1,3,5-triazine
CID 155328942

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine?
The IUPAC name of 2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine (CID 159052658) is 2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine.
What is the SMILES notation for 2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine?
The canonical SMILES for 2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine is C[Si]1(C)c2ccccc2-c2nc(-c3cccc4c3oc3ccccc34)nc(-c3cccc4c3oc3ccccc34)c21.C[Si]1(C)c2ccccc2-c2nc(-c3cccc4oc5ccccc5c34)nc(-c3cccc(-c4cccc(-c5ccc(-c6ccccc6)cc5)c4)c3)c21.C[Si]1(C)c2ccccc2-c2nc(-c3cccc4sc5ccccc5c34)nc(-c3cccc(-c4cccc(-c5ccc(-c6ccccc6)cc5)c4)c3)c21.
What is the InChIKey of 2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine?
The InChIKey is JXLRXUWCOIDLNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H34N2OSi.C48H34N2SSi.C36H24N2O2Si/c2*1-52(2)43-24-9-7-20-39(43)46-47(52)45(49-48(50-46)40-21-12-23-42-44(40)38-19-6-8-22-41(38)51-42)37-18-11-17-36(30-37)35-16-10-15-34(29-35)33-27-25-32(26-28-33)31-13-4-3-5-14-31;1-41(2)30-20-8-5-13-25(30)31-35(41)32(26-16-9-14-23-21-11-3-6-18-28(21)39-33(23)26)38-36(37-31)27-17-10-15-24-22-12-4-7-19-29(22)40-34(24)27/h2*3-30H,1-2H3;3-20H,1-2H3.
What are the key properties of 2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine?
2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine has a molecular weight of 1926.55 g/mol, XLogP of 31.91, 12 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2-dibenzothiophen-1-yl-5,5-dimethyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]-[1]benzosilolo[3,2-d]pyrimidine;2,4-di(dibenzofuran-4-yl)-5,5-dimethyl-[1]benzosilolo[3,2-d]pyrimidine is sourced from PubChem (CID 159052658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).