Nombre: 3-(4-acetylphenoxy)-5-[(1S)-2-methoxy-1-methylethoxy]-N-(1′-methyl-1H-pyrazol-3-yl)benzamide
SMILES:
COC[C@H](C)Oc1cc(Oc2ccc(C(C)=O)cc2)cc(C(=O)Nc2ccn(C)n2)c1Molecular Processing
Molecular formula
C23H25N3O5
Molecular weight
423.47
Exact mass
423.1794
XLogP
4.08
TPSA
91.68
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
31
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.261
Molar refractivity
116.09
Supplementary Information
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