Nombre: 3-hydroxy-5-{[(1S)-2-hydroxy-1-methylethyl]oxy}-N-(1-methyl-1H-pyrazol-3-yl)benzamide
SMILES:
C[C@@H](CO)Oc1cc(O)cc(C(=O)Nc2ccn(C)n2)c1Molecular Processing
Molecular formula
C14H17N3O4
Molecular weight
291.31
Exact mass
291.1219
XLogP
1.14
TPSA
96.61
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
76.44
Supplementary Information
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