tributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane

C17H29FN2SSn — CID 23449254

IUPACtributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1cn2cnc(F)c2s1
InChIInChI=1S/C5H2FN2S.3C4H9.Sn/c6-4-5-8(3-7-4)1-2-9-5;3*1-3-4-2;/h1,3H;3*1,3-4H2,2H3;
InChIKeyJGLIUSAEWPQGCY-UHFFFAOYSA-N
MW431.21 g/mol
LogP5.59
Rot. Bonds10

About tributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane

tributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane (PubChem CID 23449254) has the molecular formula C17H29FN2SSn and a molecular weight of 431.21 g/mol. Its IUPAC name is tributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane.

Molecular Properties

Compound Nametributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane
PubChem CID23449254
Molecular FormulaC17H29FN2SSn
Molecular Weight431.21 g/mol
Exact Mass432.11
IUPAC Nametributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1cn2cnc(F)c2s1
InChIInChI=1S/C5H2FN2S.3C4H9.Sn/c6-4-5-8(3-7-4)1-2-9-5;3*1-3-4-2;/h1,3H;3*1,3-4H2,2H3;
InChIKeyJGLIUSAEWPQGCY-UHFFFAOYSA-N
XLogP5.59
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500431.21
LogP ≤ 55.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of tributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane?
The IUPAC name of tributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane (CID 23449254) is tributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane.
What is the SMILES notation for tributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane?
The canonical SMILES for tributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane is CCCC[Sn](CCCC)(CCCC)c1cn2cnc(F)c2s1.
What is the InChIKey of tributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane?
The InChIKey is JGLIUSAEWPQGCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H2FN2S.3C4H9.Sn/c6-4-5-8(3-7-4)1-2-9-5;3*1-3-4-2;/h1,3H;3*1,3-4H2,2H3;.
What are the key properties of tributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane?
tributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane has a molecular weight of 431.21 g/mol, XLogP of 5.59, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-(7-fluoroimidazo[5,1-b][1,3]thiazol-2-yl)stannane is sourced from PubChem (CID 23449254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).