Molecule

ID:32451

General Information
Structure
MolImage
Molecular Formula
C₁₄H₂₄N₂O₃Si
Molecular Mass
296.43746
Exact Mass
296.15561917
Charge
0
InChI
InChI=1S/C14H24N2O3Si/c1-14(2,3)19-13(17)16-10-8-15-9-11(18-4)12(10)20(5,6)7/h8-9H,1-7H3,(H,16,17)
InChIKey
FVEQUJHTDPTPMT-UHFFFAOYSA-N
Canonic Smiles
COc1cncc(c1[Si](C)(C)C)NC(=O)OC(C)(C)C
Isomeric Smiles
c1(cncc(c1[Si](C)(C)C)NC(=O)OC(C)(C)C)OC
Calculated Properties
JChem
Acid pKa
12.207217
H Acceptors
4
H Donor
1
LogD (pH = 5.5)
2.8404129
LogD (pH = 7.4)
2.8510556
Log P
2.8512
Molar Refractivity
76.7201
Polarizability
31.51857
Polar Surface Area
60.45
Rotatable Bonds
5
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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