Molecule

ID:65664

General Information
Structure
MolImage
Molecular Formula
C₁₉H₃₂ClIN₂Si₂
Molecular Mass
506.99925
Exact Mass
506.08372778
Charge
0
InChI
InChI=1S/C19H32ClIN2Si2/c1-12(2)25(13(3)4,14(5)6)23-11-10-15-17(24(7,8)9)16(20)18(21)22-19(15)23/h10-14H,1-9H3
InChIKey
IJKXEXIAUBBVMC-UHFFFAOYSA-N
Canonic Smiles
Clc1c(I)nc2c(c1[Si](C)(C)C)ccn2[Si](C(C)C)(C(C)C)C(C)C
Isomeric Smiles
c1(c(nc2c(c1[Si](C)(C)C)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)
7.7858996
LogD (pH = 7.4)
7.7859
Log P
7.7859
Molar Refractivity
114.1656
Polarizability
48.90724
Polar Surface Area
17.82
Rotatable Bonds
5
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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