SMILES:
CC(=O)SCC(Cc1ccccc1)C(=O)NC1CCCNC(=O)C1Molecular Processing
Molecular formula
C18H24N2O3S
Molecular weight
348.47
Exact mass
348.1508
XLogP
1.91
TPSA
75.27
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
24
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
95.57
Supplementary Information
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