Nombre: 5-((4-chlorophenyl)(hydroxy)methyl)-1-methyl-6-(pyridin-3-yloxy)-3-(3-((tetrahydro-2H-pyran-2-yl)oxy)propyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione
SMILES:
Cn1c(=O)n(CCCOC2CCCCO2)c(=O)c2c(C(O)c3ccc(Cl)cc3)c(Oc3cccnc3)cnc21Molecular Processing
Molecular formula
C28H29ClN4O6
Molecular weight
553.02
Exact mass
552.1776
XLogP
3.95
TPSA
117.7
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
9
Heavy atoms
39
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
145.23
Supplementary Information
Obteniendo detalles…
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