[(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane

C36H76O3Si2Sn — CID 139814886

IUPAC[(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane
SMILESCCCC[Sn](CCCC)(CCCC)C1=C[C@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@H](C)O1
InChIInChI=1S/C24H49O3Si2.3C4H9.Sn/c1-16(2)28(17(3)4,18(5)6)26-23-14-15-25-22(13)24(23)27-29(19(7)8,20(9)10)21(11)12;3*1-3-4-2;/h14,16-24H,1-13H3;3*1,3-4H2,2H3;/t22-,23-,24-;;;;/m0..../s1
InChIKeyRNLNPOIPYMKYDZ-OYBMIZIMSA-N
MW731.88 g/mol
LogP12.80
Rot. Bonds20

About [(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane

[(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane (PubChem CID 139814886) has the molecular formula C36H76O3Si2Sn and a molecular weight of 731.88 g/mol. Its IUPAC name is [(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane
PubChem CID139814886
Molecular FormulaC36H76O3Si2Sn
Molecular Weight731.88 g/mol
Exact Mass732.44
IUPAC Name[(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane
SMILESCCCC[Sn](CCCC)(CCCC)C1=C[C@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@H](C)O1
InChIInChI=1S/C24H49O3Si2.3C4H9.Sn/c1-16(2)28(17(3)4,18(5)6)26-23-14-15-25-22(13)24(23)27-29(19(7)8,20(9)10)21(11)12;3*1-3-4-2;/h14,16-24H,1-13H3;3*1,3-4H2,2H3;/t22-,23-,24-;;;;/m0..../s1
InChIKeyRNLNPOIPYMKYDZ-OYBMIZIMSA-N
XLogP12.80
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds20
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500731.88
LogP ≤ 512.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze [(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane?
The IUPAC name of [(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane (CID 139814886) is [(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane.
What is the SMILES notation for [(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane?
The canonical SMILES for [(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane is CCCC[Sn](CCCC)(CCCC)C1=C[C@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@@H](O[Si](C(C)C)(C(C)C)C(C)C)[C@H](C)O1.
What is the InChIKey of [(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane?
The InChIKey is RNLNPOIPYMKYDZ-OYBMIZIMSA-N. The full InChI is InChI=1S/C24H49O3Si2.3C4H9.Sn/c1-16(2)28(17(3)4,18(5)6)26-23-14-15-25-22(13)24(23)27-29(19(7)8,20(9)10)21(11)12;3*1-3-4-2;/h14,16-24H,1-13H3;3*1,3-4H2,2H3;/t22-,23-,24-;;;;/m0..../s1.
What are the key properties of [(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane?
[(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane has a molecular weight of 731.88 g/mol, XLogP of 12.80, 20 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,3S,4S)-2-methyl-6-tributylstannyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane is sourced from PubChem (CID 139814886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).