Name: [6-chloro-2-(4-methoxy-benzylsulfanyl)-pyrimidin-4-yl)-(5-methyl-2H-pyrazol-3-yl)-amine
SMILES:
COc1ccc(CSc2nc(Cl)cc(Nc3cc(C)n[nH]3)n2)cc1Molecular Processing
Molecular formula
C16H16ClN5OS
Molecular weight
361.86
Exact mass
361.0764
XLogP
4.21
TPSA
75.72
H-bond donors
2
H-bond acceptors
6
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
8
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
96.2
Supplementary Information
Details werden geladen…
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