SMILES:
CCCCCCCC(=O)Nc1ccc2nc(S)[nH]c2c1Molecular Processing
Molecular formula
C15H21N3OS
Molecular weight
291.42
Exact mass
291.1405
XLogP
4.15
TPSA
57.78
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.467
Molar refractivity
85.35
Supplementary Information
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