Nombre: 2-(1-bromopropyl)-3-iodo-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
SMILES:
CCC(Br)c1nc2cccc(C)n2c(=O)c1IMolecular Processing
Molecular formula
C12H12BrIN2O
Molecular weight
407.05
Exact mass
405.9178
XLogP
3.45
TPSA
34.37
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
80.88
Supplementary Information
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