Name: 2-methylsulfanyl-pyrimidine-4-carbaldehyde
SMILES:
CSc1nccc(C=O)n1Molecular Processing
Molecular formula
C6H6N2OS
Molecular weight
154.19
Exact mass
154.0201
XLogP
1.01
TPSA
42.85
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
39.2
Supplementary Information
Details werden geladen…
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