SMILES:
CC1CCc2ncnc(N3CCN(C(=O)[C@H](CC(C)(C)N)c4ccc(Cl)cc4)CC3)c21.Cl.ClMolecular Processing
Molecular formula
C24H34Cl3N5O
Molecular weight
514.93
Exact mass
513.1829
XLogP
4.58
TPSA
75.35
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
33
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
3
Fraction Csp3
0.542
Molar refractivity
139.13
Supplementary Information
Obteniendo detalles…
Participa en 2 reacciones→