Molecule

ID:33011

General Information
Structure
MolImage
Molecular Formula
C₁₄H₂₄N₂O₂Si
Molecular Mass
280.43806
Exact Mass
280.16070455
Charge
0
InChI
InChI=1S/C14H24N2O2Si/c1-14(2,3)13(17)16-11-10(19(5,6)7)8-9-15-12(11)18-4/h8-9H,1-7H3,(H,16,17)
InChIKey
BOCMURIOZJRFDW-UHFFFAOYSA-N
Canonic Smiles
COc1nccc(c1NC(=O)C(C)(C)C)[Si](C)(C)C
Isomeric Smiles
c1cnc(c(c1[Si](C)(C)C)NC(=O)C(C)(C)C)OC
Calculated Properties
JChem
Acid pKa
11.415635
H Acceptors
3
H Donor
1
LogD (pH = 5.5)
3.9460795
LogD (pH = 7.4)
3.946355
Log P
3.9464
Molar Refractivity
75.3068
Polarizability
30.815872
Polar Surface Area
51.22
Rotatable Bonds
4
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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