CN(C(=O)OC(C)(C)C)[C@H]1CCN(C(c2ccc(Cl)nc2)C(F)(F)F)C1
SMILES: CN(C(=O)OC(C)(C)C)[C@H]1CCN(C(c2ccc(Cl)nc2)C(F)(F)F)C1

Molecular Processing

Molecular formula
C17H23ClF3N3O2
Molecular weight
393.84
Exact mass
393.1431
XLogP
4.28
TPSA
45.67
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
26
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.647
Molar refractivity
92.02

Supplementary Information

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