Nombre: 5-n-butyl-2,4-dihydro-2-[2-(trifluoromethyl)phenyl]-4-[(2'-sulfamoyl-5'-propylbiphenyl-4-yl)methyl]-3H-1,2,4-triazol-3-one
SMILES:
CCCCc1nn(-c2ccccc2C(F)(F)F)c(=O)n1Cc1ccc(-c2cc(CCC)ccc2S(N)(=O)=O)cc1Molecular Processing
Molecular formula
C29H31F3N4O3S
Molecular weight
572.65
Exact mass
572.2069
XLogP
5.71
TPSA
99.98
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
10
Heavy atoms
40
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.31
Molar refractivity
147.79
Supplementary Information
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