2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine

C135H99N9Si3 — CID 158183224

IUPAC2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine
SMILESC[Si]1(C)c2ccccc2-c2c(-c3nc(-c4ccc(-c5ccc6ccccc6c5)cc4)nc(-c4cccc(-c5ccccc5)c4)n3)cccc21.C[Si]1(C)c2ccccc2-c2cc(-c3nc(-c4ccc(-c5ccc6ccccc6c5)cc4)nc(-c4cccc(-c5ccccc5)c4)n3)ccc21.C[Si]1(C)c2ccccc2-c2ccc(-c3nc(-c4ccc(-c5ccc6ccccc6c5)cc4)nc(-c4cccc(-c5ccccc5)c4)n3)cc21
InChIInChI=1S/3C45H33N3Si/c1-49(2)40-20-9-8-18-38(40)42-39(19-11-21-41(42)49)45-47-43(46-44(48-45)37-17-10-16-35(29-37)30-12-4-3-5-13-30)33-25-22-32(23-26-33)36-27-24-31-14-6-7-15-34(31)28-36;1-49(2)41-18-9-8-17-39(41)40-29-38(25-26-42(40)49)45-47-43(46-44(48-45)37-16-10-15-35(28-37)30-11-4-3-5-12-30)33-22-19-32(20-23-33)36-24-21-31-13-6-7-14-34(31)27-36;1-49(2)41-18-9-8-17-39(41)40-26-25-38(29-42(40)49)45-47-43(46-44(48-45)37-16-10-15-35(28-37)30-11-4-3-5-12-30)33-22-19-32(20-23-33)36-24-21-31-13-6-7-14-34(31)27-36/h3*3-29H,1-2H3
InChIKeyFYVQWUKFIMPYOM-UHFFFAOYSA-N
MW1931.60 g/mol
LogP30.49
Rot. Bonds15

About 2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine

2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine (PubChem CID 158183224) has the molecular formula C135H99N9Si3 and a molecular weight of 1931.60 g/mol. Its IUPAC name is 2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine
PubChem CID158183224
Molecular FormulaC135H99N9Si3
Molecular Weight1931.60 g/mol
Exact Mass1929.73
IUPAC Name2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine
SMILESC[Si]1(C)c2ccccc2-c2c(-c3nc(-c4ccc(-c5ccc6ccccc6c5)cc4)nc(-c4cccc(-c5ccccc5)c4)n3)cccc21.C[Si]1(C)c2ccccc2-c2cc(-c3nc(-c4ccc(-c5ccc6ccccc6c5)cc4)nc(-c4cccc(-c5ccccc5)c4)n3)ccc21.C[Si]1(C)c2ccccc2-c2ccc(-c3nc(-c4ccc(-c5ccc6ccccc6c5)cc4)nc(-c4cccc(-c5ccccc5)c4)n3)cc21
InChIInChI=1S/3C45H33N3Si/c1-49(2)40-20-9-8-18-38(40)42-39(19-11-21-41(42)49)45-47-43(46-44(48-45)37-17-10-16-35(29-37)30-12-4-3-5-13-30)33-25-22-32(23-26-33)36-27-24-31-14-6-7-15-34(31)28-36;1-49(2)41-18-9-8-17-39(41)40-29-38(25-26-42(40)49)45-47-43(46-44(48-45)37-16-10-15-35(28-37)30-11-4-3-5-12-30)33-22-19-32(20-23-33)36-24-21-31-13-6-7-14-34(31)27-36;1-49(2)41-18-9-8-17-39(41)40-26-25-38(29-42(40)49)45-47-43(46-44(48-45)37-16-10-15-35(28-37)30-11-4-3-5-12-30)33-22-19-32(20-23-33)36-24-21-31-13-6-7-14-34(31)27-36/h3*3-29H,1-2H3
InChIKeyFYVQWUKFIMPYOM-UHFFFAOYSA-N
XLogP30.49
TPSA116.01 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds15
Heavy Atoms147
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001931.60
LogP ≤ 530.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze 2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine with MolForge

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Related Compounds

2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine
CID 158183226
2-[4-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)phenyl]-4-(4-naphthalen-2-ylphenyl)-6-phenyl-1,3,5-triazine
CID 170927900
2-(5,5-dimethyl-3-phenylbenzo[b][1]benzosilol-8-yl)-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
CID 155787127
2-[4-[3-[3-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]phenyl]phenyl]-4,6-bis(3-phenylphenyl)-1,3,5-triazine
CID 155787296
2-(7,7-dimethylnaphtho[2,1-b][1]benzosilol-9-yl)-4-(6-phenylnaphthalen-2-yl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 158354834
2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(9,9-dimethylfluoren-4-yl)-6-(4-naphthalen-2-ylphenyl)-1,3,5-triazine
CID 170927930
2-[4-[4-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 155787156
2-(5,5-dimethylnaphtho[2,3-b][1]benzosilol-2-yl)-4-(6-phenylnaphthalen-2-yl)-6-(2-phenylphenyl)-1,3,5-triazine
CID 157359934
2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-1-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine
CID 157199646
2-(5,5-diphenylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(5,5-diphenylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-1-ylphenyl)-6-phenyl-1,3,5-triazine;2-(5,5-diphenylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-1-ylphenyl)-6-phenyl-1,3,5-triazine
CID 157083192
2-(11,11-dimethylnaphtho[1,2-b][1]benzosilol-8-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine
CID 160898852
2-(11,11-dimethylnaphtho[1,2-b][1]benzosilol-8-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(11,11-dimethylnaphtho[1,2-b][1]benzosilol-9-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine;2-(11,11-dimethylnaphtho[1,2-b][1]benzosilol-10-yl)-4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 158802395

Frequently Asked Questions

What is the IUPAC name of 2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine?
The IUPAC name of 2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine (CID 158183224) is 2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine.
What is the SMILES notation for 2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine?
The canonical SMILES for 2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine is C[Si]1(C)c2ccccc2-c2c(-c3nc(-c4ccc(-c5ccc6ccccc6c5)cc4)nc(-c4cccc(-c5ccccc5)c4)n3)cccc21.C[Si]1(C)c2ccccc2-c2cc(-c3nc(-c4ccc(-c5ccc6ccccc6c5)cc4)nc(-c4cccc(-c5ccccc5)c4)n3)ccc21.C[Si]1(C)c2ccccc2-c2ccc(-c3nc(-c4ccc(-c5ccc6ccccc6c5)cc4)nc(-c4cccc(-c5ccccc5)c4)n3)cc21.
What is the InChIKey of 2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine?
The InChIKey is FYVQWUKFIMPYOM-UHFFFAOYSA-N. The full InChI is InChI=1S/3C45H33N3Si/c1-49(2)40-20-9-8-18-38(40)42-39(19-11-21-41(42)49)45-47-43(46-44(48-45)37-17-10-16-35(29-37)30-12-4-3-5-13-30)33-25-22-32(23-26-33)36-27-24-31-14-6-7-15-34(31)28-36;1-49(2)41-18-9-8-17-39(41)40-29-38(25-26-42(40)49)45-47-43(46-44(48-45)37-16-10-15-35(28-37)30-11-4-3-5-12-30)33-22-19-32(20-23-33)36-24-21-31-13-6-7-14-34(31)27-36;1-49(2)41-18-9-8-17-39(41)40-26-25-38(29-42(40)49)45-47-43(46-44(48-45)37-16-10-15-35(28-37)30-11-4-3-5-12-30)33-22-19-32(20-23-33)36-24-21-31-13-6-7-14-34(31)27-36/h3*3-29H,1-2H3.
What are the key properties of 2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine?
2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine has a molecular weight of 1931.60 g/mol, XLogP of 30.49, 15 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,5-dimethylbenzo[b][1]benzosilol-1-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-2-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine;2-(5,5-dimethylbenzo[b][1]benzosilol-3-yl)-4-(4-naphthalen-2-ylphenyl)-6-(3-phenylphenyl)-1,3,5-triazine is sourced from PubChem (CID 158183224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).