Nombre: 3-{4-[(2E)-3-(dimethylamino)prop-2-enoyl]phenoxy}-5-[(1S)-2-methoxy-1-methylethoxy]-N-(1-methyl-1H-pyrazol-3-yl)benzamide
SMILES:
COC[C@H](C)Oc1cc(Oc2ccc(C(=O)/C=C/N(C)C)cc2)cc(C(=O)Nc2ccn(C)n2)c1Molecular Processing
Molecular formula
C26H30N4O5
Molecular weight
478.55
Exact mass
478.2216
XLogP
4.14
TPSA
94.92
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
11
Heavy atoms
35
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.269
Molar refractivity
133.24
Supplementary Information
Obteniendo detalles…
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