Nom: 2-amino-N-[4-[4-[[1-[(4-fluorophenyl)methyl]-1H-benzimidazol-2-yl]methyl]-1-piperidinyl]-butyl]benzamide
SMILES:
Nc1ccccc1C(=O)NCCCCN1CCC(Cc2nc3ccccc3n2Cc2ccc(F)cc2)CC1Molecular Processing
Molecular formula
C31H36FN5O
Molecular weight
513.66
Exact mass
513.2904
XLogP
5.27
TPSA
76.18
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
10
Heavy atoms
38
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.355
Molar refractivity
150.52
Supplementary Information
Récupération des détails…
Impliqué dans 2 réactions→