SMILES:
Cc1ccc2[nH]c3c(cc(-c4ccc(C#N)cc4C#N)c(=O)n3C)c2c1Molecular Processing
Molecular formula
C21H14N4O
Molecular weight
338.37
Exact mass
338.1168
XLogP
3.74
TPSA
85.37
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
26
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.095
Molar refractivity
100.65
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→