Name: 6-(3-((tert-butyldimethylsilyl)oxy)-2-mercaptopropyl)-5-(3-fluorophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
SMILES:
Cn1c(=O)c2c(-c3cccc(F)c3)n(CC(S)CO[Si](C)(C)C(C)(C)C)cc2n(C)c1=OMolecular Processing
Molecular formula
C23H32FN3O3SSi
Molecular weight
477.68
Exact mass
477.1918
XLogP
4.17
TPSA
58.16
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
32
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.478
Molar refractivity
133.74
Supplementary Information
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