[7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine

C144H105N9O3Si — CID 165012266

IUPAC[7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine
SMILESC[Si](C)(C)c1cc(-c2ccccc2)c2c(c1)oc1cc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc(-c5ccccc5)cc4)n3)ccc12.Cc1ccc(-c2cccc3oc4cc(-c5nc(-c6ccc(-c7ccccc7)cc6)nc(-c6ccc(-c7ccccc7)cc6)n5)ccc4c23)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc5c(c4)oc4cccc(-c6ccc(C7CCCC7)cc6)c45)n3)cc2)cc1
InChIInChI=1S/C50H37N3O.C48H37N3OSi.C46H31N3O/c1-3-10-33(11-4-1)37-20-26-40(27-21-37)48-51-49(41-28-22-38(23-29-41)34-12-5-2-6-13-34)53-50(52-48)42-30-31-44-46(32-42)54-45-17-9-16-43(47(44)45)39-24-18-36(19-25-39)35-14-7-8-15-35;1-53(2,3)40-30-42(36-17-11-6-12-18-36)45-41-28-27-39(29-43(41)52-44(45)31-40)48-50-46(37-23-19-34(20-24-37)32-13-7-4-8-14-32)49-47(51-48)38-25-21-35(22-26-38)33-15-9-5-10-16-33;1-30-15-17-35(18-16-30)39-13-8-14-41-43(39)40-28-27-38(29-42(40)50-41)46-48-44(36-23-19-33(20-24-36)31-9-4-2-5-10-31)47-45(49-46)37-25-21-34(22-26-37)32-11-6-3-7-12-32/h1-6,9-13,16-32,35H,7-8,14-15H2;4-31H,1-3H3;2-29H,1H3
InChIKeyJWPLJMKMFZBOMQ-UHFFFAOYSA-N
MW2037.57 g/mol
LogP37.83
Rot. Bonds20

About [7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine

[7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine (PubChem CID 165012266) has the molecular formula C144H105N9O3Si and a molecular weight of 2037.57 g/mol. Its IUPAC name is [7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name[7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine
PubChem CID165012266
Molecular FormulaC144H105N9O3Si
Molecular Weight2037.57 g/mol
Exact Mass2035.81
IUPAC Name[7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine
SMILESC[Si](C)(C)c1cc(-c2ccccc2)c2c(c1)oc1cc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc(-c5ccccc5)cc4)n3)ccc12.Cc1ccc(-c2cccc3oc4cc(-c5nc(-c6ccc(-c7ccccc7)cc6)nc(-c6ccc(-c7ccccc7)cc6)n5)ccc4c23)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc5c(c4)oc4cccc(-c6ccc(C7CCCC7)cc6)c45)n3)cc2)cc1
InChIInChI=1S/C50H37N3O.C48H37N3OSi.C46H31N3O/c1-3-10-33(11-4-1)37-20-26-40(27-21-37)48-51-49(41-28-22-38(23-29-41)34-12-5-2-6-13-34)53-50(52-48)42-30-31-44-46(32-42)54-45-17-9-16-43(47(44)45)39-24-18-36(19-25-39)35-14-7-8-15-35;1-53(2,3)40-30-42(36-17-11-6-12-18-36)45-41-28-27-39(29-43(41)52-44(45)31-40)48-50-46(37-23-19-34(20-24-37)32-13-7-4-8-14-32)49-47(51-48)38-25-21-35(22-26-38)33-15-9-5-10-16-33;1-30-15-17-35(18-16-30)39-13-8-14-41-43(39)40-28-27-38(29-42(40)50-41)46-48-44(36-23-19-33(20-24-36)31-9-4-2-5-10-31)47-45(49-46)37-25-21-34(22-26-37)32-11-6-3-7-12-32/h1-6,9-13,16-32,35H,7-8,14-15H2;4-31H,1-3H3;2-29H,1H3
InChIKeyJWPLJMKMFZBOMQ-UHFFFAOYSA-N
XLogP37.83
TPSA155.43 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds20
Heavy Atoms157
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002037.57
LogP ≤ 537.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze [7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine with MolForge

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Related Compounds

2-[9-(4-cyclohexylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 164797633
2-[9-(4-cyclohexylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;trimethyl-[4-[4-(4-phenylphenyl)-6-[9-(4-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]germane;trimethyl-[4-[4-(4-phenylphenyl)-6-[9-(4-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]silane
CID 165037309
trimethyl-[4-[4-(4-phenylphenyl)-6-[9-(4-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazin-2-yl]phenyl]silane
CID 164797867
2-[4-(oxolan-3-yl)phenyl]-4-(4-phenylphenyl)-6-[9-(4-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazine
CID 164798198
2-phenyl-4-(4-phenylphenyl)-6-[9-(4-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazine
CID 164797315
2,4-bis(4-phenylphenyl)-6-[9-(4-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazine
CID 164798189
2-phenyl-4-[9-(2-phenylphenyl)dibenzofuran-3-yl]-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 164797827
2-dibenzofuran-3-yl-4-(4-dibenzofuran-1-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 139304372
2-(3,5-diphenylphenyl)-4-phenyl-6-[9-[4-(3-phenylphenyl)phenyl]dibenzofuran-3-yl]-1,3,5-triazine
CID 164797691
2-(3,4-diphenylphenyl)-4-(9-phenyldibenzofuran-3-yl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 164797807
2-[9-(3,5-diphenylphenyl)dibenzofuran-3-yl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 164797357
2,4-bis(3-phenylphenyl)-6-[9-(3-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazine;2,4-bis(4-phenylphenyl)-6-[9-(3-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazine;2-(3,5-diphenylphenyl)-4-(9-phenyldibenzofuran-3-yl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(3,5-diphenylphenyl)-4-(9-phenyldibenzofuran-3-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 165042991

Frequently Asked Questions

What is the IUPAC name of [7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine?
The IUPAC name of [7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine (CID 165012266) is [7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine.
What is the SMILES notation for [7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine?
The canonical SMILES for [7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine is C[Si](C)(C)c1cc(-c2ccccc2)c2c(c1)oc1cc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc(-c5ccccc5)cc4)n3)ccc12.Cc1ccc(-c2cccc3oc4cc(-c5nc(-c6ccc(-c7ccccc7)cc6)nc(-c6ccc(-c7ccccc7)cc6)n5)ccc4c23)cc1.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc5c(c4)oc4cccc(-c6ccc(C7CCCC7)cc6)c45)n3)cc2)cc1.
What is the InChIKey of [7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine?
The InChIKey is JWPLJMKMFZBOMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H37N3O.C48H37N3OSi.C46H31N3O/c1-3-10-33(11-4-1)37-20-26-40(27-21-37)48-51-49(41-28-22-38(23-29-41)34-12-5-2-6-13-34)53-50(52-48)42-30-31-44-46(32-42)54-45-17-9-16-43(47(44)45)39-24-18-36(19-25-39)35-14-7-8-15-35;1-53(2,3)40-30-42(36-17-11-6-12-18-36)45-41-28-27-39(29-43(41)52-44(45)31-40)48-50-46(37-23-19-34(20-24-37)32-13-7-4-8-14-32)49-47(51-48)38-25-21-35(22-26-38)33-15-9-5-10-16-33;1-30-15-17-35(18-16-30)39-13-8-14-41-43(39)40-28-27-38(29-42(40)50-41)46-48-44(36-23-19-33(20-24-36)31-9-4-2-5-10-31)47-45(49-46)37-25-21-34(22-26-37)32-11-6-3-7-12-32/h1-6,9-13,16-32,35H,7-8,14-15H2;4-31H,1-3H3;2-29H,1H3.
What are the key properties of [7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine?
[7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine has a molecular weight of 2037.57 g/mol, XLogP of 37.83, 20 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for [7-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]-1-phenyldibenzofuran-3-yl]-trimethylsilane;2-[9-(4-cyclopentylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine;2-[9-(4-methylphenyl)dibenzofuran-3-yl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine is sourced from PubChem (CID 165012266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).