Molecule

ID:65667

General Information
Structure
MolImage
Molecular Formula
C₁₆H₂₃Cl₂IN₂Si
Molecular Mass
469.26319
Exact Mass
468.00522864
Charge
0
InChI
InChI=1S/C16H23Cl2IN2Si/c1-9(2)22(10(3)4,11(5)6)21-8-7-12-13(17)14(18)15(19)20-16(12)21/h7-11H,1-6H3
InChIKey
ZXQTULCPKSGGBW-UHFFFAOYSA-N
Canonic Smiles
Clc1c(I)nc2c(c1Cl)ccn2[Si](C(C)C)(C(C)C)C(C)C
Isomeric Smiles
c1(c(nc2c(c1Cl)ccn2[Si](C(C)C)(C(C)C)C(C)C)I)Cl
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
6.7193
LogD (pH = 7.4)
6.7193
Log P
6.7193
Molar Refractivity
102.9068
Polarizability
42.458225
Polar Surface Area
17.82
Rotatable Bonds
4
Lipinski's Rule of Five
false
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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