CC(C)(C)OC(=O)Nc1csc2c1CCCC2=O
SMILES: CC(C)(C)OC(=O)Nc1csc2c1CCCC2=O

Molecular Processing

Molecular formula
C13H17NO3S
Molecular weight
267.35
Exact mass
267.0929
XLogP
3.61
TPSA
55.4
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
71.44

Supplementary Information

Details werden geladen…

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