Name: 5-((4-chlorophenyl)(hydroxy)methyl)-1-methyl-3-(3-((tetrahydro-2H-pyran-2-yl)oxy)propyl)-6-((5-(trifluoromethyl)pyridin-3-yl)oxy)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione
SMILES:
Cn1c(=O)n(CCCOC2CCCCO2)c(=O)c2c(C(O)c3ccc(Cl)cc3)c(Oc3cncc(C(F)(F)F)c3)cnc21Molecular Processing
Molecular formula
C29H28ClF3N4O6
Molecular weight
621.01
Exact mass
620.1649
XLogP
4.97
TPSA
117.7
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
9
Heavy atoms
43
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.379
Molar refractivity
150.23
Supplementary Information
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