Molecule

ID:51658

General Information
Structure
MolImage
Molecular Formula
C₁₇H₂₅F₃N₂Si
Molecular Mass
342.4745096
Exact Mass
342.17391
Charge
0
InChI
InChI=1S/C17H25F3N2Si/c1-11(2)23(12(3)4,13(5)6)22-8-7-14-9-15(17(18,19)20)10-21-16(14)22/h7-13H,1-6H3
InChIKey
GESOHXDEZSURSM-UHFFFAOYSA-N
Canonic Smiles
CC([Si](n1ccc2c1ncc(c2)C(F)(F)F)(C(C)C)C(C)C)C
Isomeric Smiles
c1(cnc2c(c1)ccn2[Si](C(C)C)(C(C)C)C(C)C)C(F)(F)F
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
5.3745985
LogD (pH = 7.4)
5.378253
Log P
5.3783
Molar Refractivity
86.2003
Polarizability
34.435085
Polar Surface Area
17.82
Rotatable Bonds
5
Lipinski's Rule of Five
false
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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