Molecule

ID:8580

General Information
Structure
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Molecular Formula
C₁₆H₃₀N₂Sn
Molecular Mass
369.1238
Exact Mass
370.14309297
Charge
0
InChI
InChI=1S/C4H3N2.3C4H9.Sn/c1-2-6-4-3-5-1;3*1-3-4-2;/h1-3H;3*1,3-4H2,2H3;
InChIKey
OVBXTKIWZAHFAC-UHFFFAOYSA-N
Canonic Smiles
CCCC[Sn](c1nccnc1)(CCCC)CCCC
Isomeric Smiles
c1cnc(cn1)[Sn](CCCC)(CCCC)CCCC
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
3.2056227
LogD (pH = 7.4)
3.205699
Log P
3.2057
Molar Refractivity
79.8897
Polarizability
35.973995
Polar Surface Area
25.78
Rotatable Bonds
10
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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