Name: [5-(4-iodophenyl)-[1,3,4]oxadiazol-2-ylmethyl]-dimethylamine
SMILES:
CN(C)Cc1nnc(-c2ccc(I)cc2)o1Molecular Processing
Molecular formula
C11H12IN3O
Molecular weight
329.14
Exact mass
329.0025
XLogP
2.4
TPSA
42.16
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
69.84
Supplementary Information
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