SMILES:
C[C@H]1C(=O)N(CCCN2CCC3(CC3)[C@H](O)C2)CCN1c1ccc(Cl)c(OC(F)(F)F)c1Molecular Processing
Molecular formula
C22H29ClF3N3O3
Molecular weight
475.94
Exact mass
475.185
XLogP
3.51
TPSA
56.25
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
32
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.682
Molar refractivity
114.87
Supplementary Information
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