이름: Intermediate ( 2b )
SMILES:
CCCCc1nc(Cl)c(C=O)n1Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1Molecular Processing
Molecular formula
C19H26ClN3O3S
Molecular weight
411.96
Exact mass
411.1383
XLogP
3.82
TPSA
81.06
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
27
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
0.474
Molar refractivity
106.86
Supplementary Information
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