Nombre: 5-isopropyl-N-[6-(4-hydroxy-2-butynyloxy)-5-(o-methoxyphenoxy)-4-pyrimidinyl]-2-pyridine sulfonamide
SMILES:
COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)C)cn2)ncnc1OCC#CCOMolecular Processing
Molecular formula
C23H24N4O6S
Molecular weight
484.53
Exact mass
484.1417
XLogP
2.97
TPSA
132.76
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
9
Heavy atoms
34
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.261
Molar refractivity
124.59
Supplementary Information
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