SMILES:
COc1ccc(F)c(Cl)c1C(C)c1c[nH]c2ncc(-c3cnc(C)n3C)cc12Molecular Processing
Molecular formula
C21H20ClFN4O
Molecular weight
398.87
Exact mass
398.131
XLogP
5.22
TPSA
55.73
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
28
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.238
Molar refractivity
108.51
Supplementary Information
Загрузка подробностей…
Участвует в 1 реакциях→