COc1ccc(-c2cc(=S)n(C)c(=O)[nH]2)cc1OC
SMILES: COc1ccc(-c2cc(=S)n(C)c(=O)[nH]2)cc1OC

Molecular Processing

Molecular formula
C13H14N2O3S
Molecular weight
278.33
Exact mass
278.0725
XLogP
2.13
TPSA
56.25
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
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
0.231
Molar refractivity
75.41

Supplementary Information

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