Nombre: product
SMILES:
COC(=O)c1ccc(Cc2c(C)nc(N)nc2Cl)c(F)c1Molecular Processing
Molecular formula
C14H13ClFN3O2
Molecular weight
309.73
Exact mass
309.068
XLogP
2.54
TPSA
78.1
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
76.74
Supplementary Information
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