名称: (5R)-5-[(1,3-benzothiazol-2-ylsulfonyl)methyl]pyrrolidin-2-one
SMILES:
O=C1CC[C@H](CS(=O)(=O)c2nc3ccccc3s2)N1Molecular Processing
Molecular formula
C12H12N2O3S2
Molecular weight
296.37
Exact mass
296.0289
XLogP
1.35
TPSA
76.13
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
72.84
Supplementary Information
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