Name: 2-chloro-5-fluoro-4-methylthiopyrimidine
SMILES:
CSc1nc(Cl)ncc1FMolecular Processing
Molecular formula
C5H4ClFN2S
Molecular weight
178.62
Exact mass
177.9768
XLogP
1.99
TPSA
25.78
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
38.78
Supplementary Information
Details werden geladen…
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