Nombre: 3-fluoro-5-(4-methyl-2-oxo-2,3-dihydro-benzoxazole-6-carbonyl)-benzonitrile
SMILES:
Cc1cc(C(=O)c2cc(F)cc(C#N)c2)cc2oc(=O)[nH]c12Molecular Processing
Molecular formula
C16H9FN2O3
Molecular weight
296.26
Exact mass
296.0597
XLogP
2.67
TPSA
86.86
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
76.12
Supplementary Information
Obteniendo detalles…
Participa en 3 reacciones→