[2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane

C20H19NO2SSi — CID 140719581

IUPAC[2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccnc(-c2ccc3c(c2)-c2ccccc2S3(=O)=O)c1
InChIInChI=1S/C20H19NO2SSi/c1-25(2,3)15-10-11-21-18(13-15)14-8-9-20-17(12-14)16-6-4-5-7-19(16)24(20,22)23/h4-13H,1-3H3
InChIKeyISMBPVRIKCUSSK-UHFFFAOYSA-N
MW365.53 g/mol
LogP4.11
Rot. Bonds2

About [2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane

[2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane (PubChem CID 140719581) has the molecular formula C20H19NO2SSi and a molecular weight of 365.53 g/mol. Its IUPAC name is [2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane.

Molecular Properties

Compound Name[2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane
PubChem CID140719581
Molecular FormulaC20H19NO2SSi
Molecular Weight365.53 g/mol
Exact Mass365.09
IUPAC Name[2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccnc(-c2ccc3c(c2)-c2ccccc2S3(=O)=O)c1
InChIInChI=1S/C20H19NO2SSi/c1-25(2,3)15-10-11-21-18(13-15)14-8-9-20-17(12-14)16-6-4-5-7-19(16)24(20,22)23/h4-13H,1-3H3
InChIKeyISMBPVRIKCUSSK-UHFFFAOYSA-N
XLogP4.11
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.53
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze [2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane 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

[6-(5,5-dioxodibenzothiophen-3-yl)-3-pyridinyl]-dimethyl-phenylsilane
CID 140720125
2-[5-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]dibenzothiophene 5,5-dioxide
CID 163613885
2-(4-chlorophenyl)dibenzothiophene 5,5-dioxide
CID 148523872
carbanide;dibenzothiophene 5,5-dioxide;ethane;tricosakis(yttrium)
CID 158868960
(2-dibenzothiophen-2-yl-4-pyridinyl)-trimethylsilane
CID 140719910
2-(3-chlorophenyl)dibenzothiophene 5,5-dioxide
CID 169131798
4-(2,6-diphenylpyrimidin-4-yl)-26λ6-thiahexacyclo[25.4.0.02,7.08,13.014,19.020,25]hentriaconta-1(31),2(7),3,5,8,10,12,14,16,18,20,22,24,27,29-pentadecaene 26,26-dioxide
CID 134572058
dimethyl-phenyl-(2-phenyl-4-pyridinyl)silane
CID 140629348
2-[4-(1,10-phenanthrolin-2-yl)naphthalen-1-yl]dibenzothiophene 5,5-dioxide
CID 164823132
2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]dibenzothiophene 5,5-dioxide
CID 169131621
trimethyl-[2-[3-(2-phenylpropan-2-yl)phenyl]-4-pyridinyl]silane
CID 162707277
2-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)dibenzothiophene 5,5-dioxide
CID 163540814

Frequently Asked Questions

What is the IUPAC name of [2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane?
The IUPAC name of [2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane (CID 140719581) is [2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane.
What is the SMILES notation for [2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane?
The canonical SMILES for [2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane is C[Si](C)(C)c1ccnc(-c2ccc3c(c2)-c2ccccc2S3(=O)=O)c1.
What is the InChIKey of [2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane?
The InChIKey is ISMBPVRIKCUSSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO2SSi/c1-25(2,3)15-10-11-21-18(13-15)14-8-9-20-17(12-14)16-6-4-5-7-19(16)24(20,22)23/h4-13H,1-3H3.
What are the key properties of [2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane?
[2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane has a molecular weight of 365.53 g/mol, XLogP of 4.11, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(5,5-dioxodibenzothiophen-2-yl)-4-pyridinyl]-trimethylsilane is sourced from PubChem (CID 140719581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).