CC(COC)OC1=CC(=CC(=C1)O)C(=O)NC2=NN(C=C2)C
Nombre: 3-hydroxy-5-[(2S)-1-methoxypropan-2-yl]oxy-N-(1-methylpyrazol-3-yl)benzamide
SMILES: CC(COC)OC1=CC(=CC(=C1)O)C(=O)NC2=NN(C=C2)C

Molecular Processing

Molecular formula
C15H19N3O4
Molecular weight
305.33
Exact mass
305.1376
XLogP
1.79
TPSA
85.61
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
81.23

Supplementary Information

InChIKey: QHHJDJYERISQPI-JTQLQIEISA-N
Sinónimos
SCHEMBL1146806QHHJDJYERISQPI-JTQLQIEISA-N3-hydroxy-5-[(1S)-2-methoxy-(1 methylethyl)oxy]-N-(1-methyl-1H-pyrazol-3-yl)benzamide3-hydroxy-5-[(1S)-2-methoxy-(1-methylethyl)oxy]-N-(1-methyl-1H-pyrazol-3-yl)benzamide3-hydroxy-5-{[(2S)-1-methoxypropan-2-yl]oxy}-N-(1-methyl-1H-pyrazol-3-yl)benzamide
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