الاسم: propiophenone
SMILES:
COc1ccc2nc(NC(=O)CC(=O)c3ccccc3)sc2c1Molecular Processing
Molecular formula
C17H14N2O3S
Molecular weight
326.38
Exact mass
326.0725
XLogP
3.52
TPSA
68.29
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.118
Molar refractivity
90.19
Supplementary Information
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