SMILES:
COc1cc2c(CC(=O)N3CCC(Cc4ccccc4)CC3)cnc(CN)c2cc1OC.ClMolecular Processing
Molecular formula
C26H32ClN3O3
Molecular weight
470.01
Exact mass
469.2132
XLogP
4.16
TPSA
77.68
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
2
Fraction Csp3
0.385
Molar refractivity
133.14
Supplementary Information
Obteniendo detalles…
Participa en 1 reacciones→