chloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one

C24H52ClN3O3S3Si3 — CID 158347417

IUPACchloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one
SMILESCC1(C)N=C(O[Si](C)(C)C)CS1.CC1(C)NC(=O)CS1.CC1(C)SCC(=O)N1[Si](C)(C)C.C[Si](C)(C)Cl
InChIInChI=1S/2C8H17NOSSi.C5H9NOS.C3H9ClSi/c1-8(2)9-7(6-11-8)10-12(3,4)5;1-8(2)9(12(3,4)5)7(10)6-11-8;1-5(2)6-4(7)3-8-5;1-5(2,3)4/h2*6H2,1-5H3;3H2,1-2H3,(H,6,7);1-3H3
InChIKeyGRXCJYGSDPJYNA-UHFFFAOYSA-N
MW646.61 g/mol
LogP7.50
Rot. Bonds2

About chloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one

chloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one (PubChem CID 158347417) has the molecular formula C24H52ClN3O3S3Si3 and a molecular weight of 646.61 g/mol. Its IUPAC name is chloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Namechloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one
PubChem CID158347417
Molecular FormulaC24H52ClN3O3S3Si3
Molecular Weight646.61 g/mol
Exact Mass645.22
IUPAC Namechloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one
SMILESCC1(C)N=C(O[Si](C)(C)C)CS1.CC1(C)NC(=O)CS1.CC1(C)SCC(=O)N1[Si](C)(C)C.C[Si](C)(C)Cl
InChIInChI=1S/2C8H17NOSSi.C5H9NOS.C3H9ClSi/c1-8(2)9-7(6-11-8)10-12(3,4)5;1-8(2)9(12(3,4)5)7(10)6-11-8;1-5(2)6-4(7)3-8-5;1-5(2,3)4/h2*6H2,1-5H3;3H2,1-2H3,(H,6,7);1-3H3
InChIKeyGRXCJYGSDPJYNA-UHFFFAOYSA-N
XLogP7.50
TPSA71.00 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500646.61
LogP ≤ 57.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one?
The IUPAC name of chloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one (CID 158347417) is chloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one.
What is the SMILES notation for chloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one?
The canonical SMILES for chloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one is CC1(C)N=C(O[Si](C)(C)C)CS1.CC1(C)NC(=O)CS1.CC1(C)SCC(=O)N1[Si](C)(C)C.C[Si](C)(C)Cl.
What is the InChIKey of chloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one?
The InChIKey is GRXCJYGSDPJYNA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H17NOSSi.C5H9NOS.C3H9ClSi/c1-8(2)9-7(6-11-8)10-12(3,4)5;1-8(2)9(12(3,4)5)7(10)6-11-8;1-5(2)6-4(7)3-8-5;1-5(2,3)4/h2*6H2,1-5H3;3H2,1-2H3,(H,6,7);1-3H3.
What are the key properties of chloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one?
chloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one has a molecular weight of 646.61 g/mol, XLogP of 7.50, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for chloro(trimethyl)silane;2,2-dimethyl-1,3-thiazolidin-4-one;(2,2-dimethyl-5H-1,3-thiazol-4-yl)oxy-trimethylsilane;2,2-dimethyl-3-trimethylsilyl-1,3-thiazolidin-4-one is sourced from PubChem (CID 158347417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).