SMILES:
CNN(NC)C(=S)Oc1cc(C)ccc1C(=O)OCMolecular Processing
Molecular formula
C12H17N3O3S
Molecular weight
283.35
Exact mass
283.0991
XLogP
1.02
TPSA
62.83
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
75.7
Supplementary Information
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