名称: ethyl 4-(2-fluoro-4-(methylthio)phenylamino)-1,5-dimethyl-6-oxo-1,6-dihydropyridazine-3-carboxylate
SMILES:
CCOC(=O)c1nn(C)c(=O)c(C)c1Nc1ccc(SC)cc1FMolecular Processing
Molecular formula
C16H18FN3O3S
Molecular weight
351.4
Exact mass
351.1053
XLogP
2.87
TPSA
73.22
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.312
Molar refractivity
91.64
Supplementary Information
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