Nombre: 2-[5-(7-Bromo-9,9-difluoro-9H-fluoren-2-yl)-1H-imidazol-2-yl]-pyrrolidine-1-carboxylic acid tert-butyl ester
SMILES:
CC(C)(C)OC(=O)N1CCCC1c1ncc(-c2ccc3c(c2)C(F)(F)c2cc(Br)ccc2-3)[nH]1Molecular Processing
Molecular formula
C25H24BrF2N3O2
Molecular weight
516.39
Exact mass
515.102
XLogP
7.03
TPSA
58.22
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
33
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.36
Molar refractivity
125.07
Supplementary Information
Obteniendo detalles…
Participa en 10 reacciones→