名称: solution
SMILES:
COc1ccc(Cl)cc1C(=O)Nc1ncc(C(C)(C)C)s1Molecular Processing
Molecular formula
C15H17ClN2O2S
Molecular weight
324.83
Exact mass
324.0699
XLogP
4.35
TPSA
51.22
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
86.77
Supplementary Information
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