tributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane

C21H33N3Sn — CID 140557189

IUPACtributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1ccc(-c2cccnc2)nn1
InChIInChI=1S/C9H6N3.3C4H9.Sn/c1-3-8(7-10-5-1)9-4-2-6-11-12-9;3*1-3-4-2;/h1-5,7H;3*1,3-4H2,2H3;
InChIKeyIQOXPHOBPKKYIQ-UHFFFAOYSA-N
MW446.23 g/mol
LogP5.59
Rot. Bonds11

About tributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane

tributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane (PubChem CID 140557189) has the molecular formula C21H33N3Sn and a molecular weight of 446.23 g/mol. Its IUPAC name is tributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane.

Molecular Properties

Compound Nametributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane
PubChem CID140557189
Molecular FormulaC21H33N3Sn
Molecular Weight446.23 g/mol
Exact Mass447.17
IUPAC Nametributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane
SMILESCCCC[Sn](CCCC)(CCCC)c1ccc(-c2cccnc2)nn1
InChIInChI=1S/C9H6N3.3C4H9.Sn/c1-3-8(7-10-5-1)9-4-2-6-11-12-9;3*1-3-4-2;/h1-5,7H;3*1,3-4H2,2H3;
InChIKeyIQOXPHOBPKKYIQ-UHFFFAOYSA-N
XLogP5.59
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500446.23
LogP ≤ 55.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze tributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane 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

3-phenyl-6-pyridin-3-ylpyridazine
CID 12712239
3-methyl-6-pyridin-3-ylpyridazine
CID 89161646
5-hexyl-3-pyridin-3-yl-1,2-oxazole
CID 134695050
3-(1-butylimidazol-4-yl)pyridine
CID 58668046
tributyl-(4-phenyl-2-pyridinyl)stannane
CID 67508437
bis(2-methylpropane);3-pyridin-3-ylpyridine
CID 158581875
2-N-(6-pyridin-3-ylpyridazin-3-yl)propane-1,2-diamine
CID 116970540
tributyl-(5-methyl-6-phenyl-2-pyridinyl)stannane
CID 67397521
tributyl-[2-(6-phenyl-4-tributylstannylpyridazin-3-yl)-3-pyridinyl]stannane
CID 86079466
1-pentyl-4-pyridin-3-ylimidazol-2-amine
CID 162675846
2-bromo-3-ethyl-6-pyridin-3-ylpyridine
CID 175213235
N-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)pentanamide
CID 4621791

Frequently Asked Questions

What is the IUPAC name of tributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane?
The IUPAC name of tributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane (CID 140557189) is tributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane.
What is the SMILES notation for tributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane?
The canonical SMILES for tributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane is CCCC[Sn](CCCC)(CCCC)c1ccc(-c2cccnc2)nn1.
What is the InChIKey of tributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane?
The InChIKey is IQOXPHOBPKKYIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6N3.3C4H9.Sn/c1-3-8(7-10-5-1)9-4-2-6-11-12-9;3*1-3-4-2;/h1-5,7H;3*1,3-4H2,2H3;.
What are the key properties of tributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane?
tributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane has a molecular weight of 446.23 g/mol, XLogP of 5.59, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-(6-pyridin-3-ylpyridazin-3-yl)stannane is sourced from PubChem (CID 140557189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).