SMILES:
Cc1csc2nc(-c3ccncc3)nc(NCCc3ccc4c(c3)OCCO4)c12Molecular Processing
Molecular formula
C22H20N4O2S
Molecular weight
404.5
Exact mass
404.1307
XLogP
4.49
TPSA
69.16
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
29
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.227
Molar refractivity
115.01
Supplementary Information
Obteniendo detalles…
Participa en 5 reacciones→