이름: N-(4-iodophenyl)-N-(2-methoxyethyl)pyrimidin-2-amine
SMILES:
COCCN(c1ccc(I)cc1)c1ncccn1Molecular Processing
Molecular formula
C13H14IN3O
Molecular weight
355.18
Exact mass
355.0182
XLogP
2.87
TPSA
38.25
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
18
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
0.231
Molar refractivity
80.07
Supplementary Information
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