Molecule

ID:59189

General Information
Structure
MolImage
Molecular Formula
C₈H₁₄N₂O₂Si
Molecular Mass
198.29446
Exact Mass
198.08245423
Charge
0
InChI
InChI=1S/C8H14N2O2Si/c1-12-8(11)6-5-7(10-9-6)13(2,3)4/h5H,1-4H3,(H,9,10)
InChIKey
JYQSBWRFQHDWHL-UHFFFAOYSA-N
Canonic Smiles
COC(=O)c1n[nH]c(c1)[Si](C)(C)C
Isomeric Smiles
c1([nH]nc(c1)C(=O)OC)[Si](C)(C)C
Calculated Properties
JChem
Acid pKa
10.386584
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
1.8479941
LogD (pH = 7.4)
1.8475631
Log P
1.848
Molar Refractivity
46.7156
Polarizability
20.066484
Polar Surface Area
54.98
Rotatable Bonds
3
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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