SMILES:
CN1CCC(N2CCN(c3ccc(NC=C4C(=O)NC(=O)c5ccc(I)cc54)cc3)CC2)CC1Molecular Processing
Molecular formula
C26H30IN5O2
Molecular weight
571.46
Exact mass
571.1444
XLogP
3.23
TPSA
67.92
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
34
Rings
5
Aromatic rings
2
Saturated rings
2
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
143.98
Supplementary Information
Details werden geladen…
An 1 Reaktionen beteiligt→