이름: 6-chloro-N-(3-methyl-1H-pyrazol-5-yl)-2-(methylsulfonyl)pyrimidin-4-amine
SMILES:
Cc1cc(Nc2cc(Cl)nc(S(C)(=O)=O)n2)[nH]n1Molecular Processing
Molecular formula
C9H10ClN5O2S
Molecular weight
287.73
Exact mass
287.0244
XLogP
1.31
TPSA
100.63
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
66.76
Supplementary Information
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