SMILES:
CC(C)N(NC(=O)c1ccccc1)C(=O)CSc1ccccc1BrMolecular Processing
Molecular formula
C18H19BrN2O2S
Molecular weight
407.33
Exact mass
406.0351
XLogP
4.12
TPSA
49.41
H-bond donors
1
H-bond acceptors
3
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
6
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
100.76
Supplementary Information
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