CCCCN(C)Cc1cc(C)cc(C(=O)N[C@@H](Cc2cc(F)cc(F)c2)[C@H](O)CNC2(c3ccccc3)CC2)c1.Cl.Cl
SMILES: CCCCN(C)Cc1cc(C)cc(C(=O)N[C@@H](Cc2cc(F)cc(F)c2)[C@H](O)CNC2(c3ccccc3)CC2)c1.Cl.Cl

Molecular Processing

Molecular formula
C33H43Cl2F2N3O2
Molecular weight
622.63
Exact mass
621.27
XLogP
6.33
TPSA
64.6
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
14
Heavy atoms
42
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
3
Fraction Csp3
0.424
Molar refractivity
169.6

Supplementary Information

Récupération des détails…

Impliqué dans 2 réactions→

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→