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Chem N Butyl Phthalimide | Cheminformatics

N-Butyl Phthalimide


  • SKU Code: CH137413
Chemical Name - N-Butyl Phthalimide
Mol Weight - 203.24
Smiles - CCCCN(C(c1c2cccc1)=O)C2=O
Property Name Property Value
Mol NameN-Butyl Phthalimide
Molweight203.24
Monoisotopic Mass203.094629
Clogp2.3087
Clogs-2.465
H Acceptors3
Total Surface Area159.1
Relative Psa0.18624
Polar Surface Area37.38
Druglikeness1.2025
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.6
Molecular Flexibility0.34539
Molecular Complexity0.74882
Fragments1
Non H Atoms15
Non Ch Atoms3
Electronegative Atoms3
Rotatable Bonds3
Rings Closures2
Small Rings2
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms4
Symmetric Atoms5
Amides1
SmilesCCCCN(C(c1c2cccc1)=O)C2=O
InChIKeyInChI=1S/C12H13NO2/c1-2-3-8-13-11(14)9-6-4-5-7-10(9)12(13)15/h4-7H,2-3,8H2,1H3
InChIDLKDEVCJRCPTLN-UHFFFAOYSA-N

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