[1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane

C10H17Br2NOSSi — CID 173095524

IUPAC[1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane
SMILESC[SiH](C)OC(c1sc(Br)nc1Br)C(C)(C)C
InChIInChI=1S/C10H17Br2NOSSi/c1-10(2,3)7(14-16(4)5)6-8(11)13-9(12)15-6/h7,16H,1-5H3
InChIKeyKSATWHILRAITNB-UHFFFAOYSA-N
MW387.21 g/mol
LogP4.76
Rot. Bonds3

About [1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane

[1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane (PubChem CID 173095524) has the molecular formula C10H17Br2NOSSi and a molecular weight of 387.21 g/mol. Its IUPAC name is [1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane.

Molecular Properties

Compound Name[1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane
PubChem CID173095524
Molecular FormulaC10H17Br2NOSSi
Molecular Weight387.21 g/mol
Exact Mass384.92
IUPAC Name[1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane
SMILESC[SiH](C)OC(c1sc(Br)nc1Br)C(C)(C)C
InChIInChI=1S/C10H17Br2NOSSi/c1-10(2,3)7(14-16(4)5)6-8(11)13-9(12)15-6/h7,16H,1-5H3
InChIKeyKSATWHILRAITNB-UHFFFAOYSA-N
XLogP4.76
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.21
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane?
The IUPAC name of [1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane (CID 173095524) is [1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane.
What is the SMILES notation for [1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane?
The canonical SMILES for [1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane is C[SiH](C)OC(c1sc(Br)nc1Br)C(C)(C)C.
What is the InChIKey of [1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane?
The InChIKey is KSATWHILRAITNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17Br2NOSSi/c1-10(2,3)7(14-16(4)5)6-8(11)13-9(12)15-6/h7,16H,1-5H3.
What are the key properties of [1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane?
[1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane has a molecular weight of 387.21 g/mol, XLogP of 4.76, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,4-dibromo-1,3-thiazol-5-yl)-2,2-dimethylpropoxy]-dimethylsilane is sourced from PubChem (CID 173095524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).