SMILES:
CNC(=O)Nc1ccc(-c2ncc3c(n2)N2CCOCC2(C)C(=O)N3CC2CC2)cc1Molecular Processing
Molecular formula
C22H26N6O3
Molecular weight
422.49
Exact mass
422.2066
XLogP
2.25
TPSA
99.69
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
31
Rings
5
Aromatic rings
2
Saturated rings
2
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
117.19
Supplementary Information
Details werden geladen…
An 3 Reaktionen beteiligt→