Nom: 3-[3-(3-methoxypropyl)-5-(6-phenylpyridin-3-yl)-1,2,4-triazol-4-yl]-2-methylbenzamide
SMILES:
COCCCc1nnc(-c2ccc(-c3ccccc3)nc2)n1-c1cccc(C(N)=O)c1CMolecular Processing
Molecular formula
C25H25N5O2
Molecular weight
427.51
Exact mass
427.2008
XLogP
3.98
TPSA
95.92
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
32
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
123.48
Supplementary Information
Récupération des détails…
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