tributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane

C20H32N2OSn — CID 15362146

IUPACtributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1cnnc(-c2ccco2)c1
InChIInChI=1S/C8H5N2O.3C4H9.Sn/c1-3-7(10-9-5-1)8-4-2-6-11-8;3*1-3-4-2;/h2-6H;3*1,3-4H2,2H3;
InChIKeyTYHHSGQCARANEC-UHFFFAOYSA-N
MW435.20 g/mol
LogP5.79
Rot. Bonds11

About tributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane

tributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane (PubChem CID 15362146) has the molecular formula C20H32N2OSn and a molecular weight of 435.20 g/mol. Its IUPAC name is tributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane.

Molecular Properties

Compound Nametributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane
PubChem CID15362146
Molecular FormulaC20H32N2OSn
Molecular Weight435.20 g/mol
Exact Mass436.15
IUPAC Nametributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1cnnc(-c2ccco2)c1
InChIInChI=1S/C8H5N2O.3C4H9.Sn/c1-3-7(10-9-5-1)8-4-2-6-11-8;3*1-3-4-2;/h2-6H;3*1,3-4H2,2H3;
InChIKeyTYHHSGQCARANEC-UHFFFAOYSA-N
XLogP5.79
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500435.20
LogP ≤ 55.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of tributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane?
The IUPAC name of tributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane (CID 15362146) is tributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane.
What is the SMILES notation for tributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane?
The canonical SMILES for tributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane is CCCC[Sn](CCCC)(CCCC)c1cnnc(-c2ccco2)c1.
What is the InChIKey of tributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane?
The InChIKey is TYHHSGQCARANEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5N2O.3C4H9.Sn/c1-3-7(10-9-5-1)8-4-2-6-11-8;3*1-3-4-2;/h2-6H;3*1,3-4H2,2H3;.
What are the key properties of tributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane?
tributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane has a molecular weight of 435.20 g/mol, XLogP of 5.79, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-[6-(furan-2-yl)pyridazin-4-yl]stannane is sourced from PubChem (CID 15362146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).