SMILES:
CC1(C(=O)O)C[SH]=C(c2ccccc2)N1Molecular Processing
Molecular formula
C11H13NO2S
Molecular weight
223.3
Exact mass
223.0667
XLogP
1.08
TPSA
49.33
H-bond donors
3
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
63.58
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→