COc1ccc(-c2ccc3cnc(S(C)=O)nn23)c(OC)c1
SMILES: COc1ccc(-c2ccc3cnc(S(C)=O)nn23)c(OC)c1

Molecular Processing

Molecular formula
C15H15N3O3S
Molecular weight
317.37
Exact mass
317.0834
XLogP
2.15
TPSA
65.72
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
83.86

Supplementary Information

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