Molecule

ID:64311

General Information
Structure
MolImage
Molecular Formula
C₉H₁₁ClF₃NSi
Molecular Mass
253.7240496
Exact Mass
253.03013823
Charge
0
InChI
InChI=1S/C9H11ClF3NSi/c1-15(2,3)6-4-5-7(9(11,12)13)14-8(6)10/h4-5H,1-3H3
InChIKey
HQEZYGMWAMEGPS-UHFFFAOYSA-N
Canonic Smiles
Clc1nc(ccc1[Si](C)(C)C)C(F)(F)F
Isomeric Smiles
n1c(c(ccc1C(F)(F)F)[Si](C)(C)C)Cl
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
4.4899
LogD (pH = 7.4)
4.4899
Log P
4.4899
Molar Refractivity
51.4325
Polarizability
21.053143
Polar Surface Area
12.89
Rotatable Bonds
2
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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