Название: (2R)-1-[3,5-bis(trifluoromethyl)benzoyl]-2-(3,4-dimethylbenzyl)-4-[2-(2-hydroxyethoxy)ethyl]piperazine
SMILES:
Cc1ccc(C[C@@H]2CN(CCOCCO)CCN2C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1CMolecular Processing
Molecular formula
C26H30F6N2O3
Molecular weight
532.52
Exact mass
532.2161
XLogP
4.72
TPSA
53.01
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
37
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
125.24
Supplementary Information
Загрузка подробностей…
Участвует в 2 реакциях→