Nombre: isothioureido
SMILES:
C=Cc1cnc(C)c(O)c1CNC(=N)S.ClMolecular Processing
Molecular formula
C10H14ClN3OS
Molecular weight
259.76
Exact mass
259.0546
XLogP
2.11
TPSA
69
H-bond donors
4
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.2
Molar refractivity
71.53
Supplementary Information
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