Name: (1R,3S)-3-isopropyl-3-(4-[6-methyl-4-(trifluoromethyl)pyridin-2-yl]piperazin-1-ylcarbonyl)cyclopentanamine
SMILES:
Cc1cc(C(F)(F)F)cc(N2CCN(C(=O)[C@@]3(C(C)C)CC[C@@H](N)C3)CC2)n1Molecular Processing
Molecular formula
C20H29F3N4O
Molecular weight
398.47
Exact mass
398.2293
XLogP
3.21
TPSA
62.46
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
28
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.7
Molar refractivity
101.87
Supplementary Information
Details werden geladen…
An 8 Reaktionen beteiligt→