Nombre: 2-(2,4-difluorophenyl)-1,1-difluoro-1-[(2-methoxyethyl)thio]-3-(1H-1,2,4-triazol-1-yl)-2-propanol
SMILES:
COCCSC(F)(F)C(O)(Cn1cncn1)c1ccc(F)cc1FMolecular Processing
Molecular formula
C14H15F4N3O2S
Molecular weight
365.35
Exact mass
365.0821
XLogP
2.42
TPSA
60.17
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
79.56
Supplementary Information
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