Nom: 5-(5-bromoacetyl-2-n-propoxyphenyl)-1-methyl-3-n-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
SMILES:
CCCOc1ccc(C(=O)CBr)cc1-c1nc2c(CCC)nn(C)c2c(=O)[nH]1Molecular Processing
Molecular formula
C20H23BrN4O3
Molecular weight
447.33
Exact mass
446.0954
XLogP
3.64
TPSA
89.87
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
28
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
112.47
Supplementary Information
Récupération des détails…
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