الاسم: 3-methyl-6-(2-n-propoxyphenyl)-1-n-propyl-1,5-dihydro-4H-pyrazolo-[3,4-d]pyrimidin-4-one
SMILES:
CCCOc1ccccc1-c1nc2c(c(C)nn2CCC)c(=O)[nH]1Molecular Processing
Molecular formula
C18H22N4O2
Molecular weight
326.4
Exact mass
326.1743
XLogP
3.29
TPSA
72.8
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.389
Molar refractivity
94.4
Supplementary Information
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