O=C(NCC(=O)N1CCC(Oc2ccccc2C(F)(F)F)CC1)c1cn(-c2ccccc2)cn1
SMILES: O=C(NCC(=O)N1CCC(Oc2ccccc2C(F)(F)F)CC1)c1cn(-c2ccccc2)cn1

Molecular Processing

Molecular formula
C24H23F3N4O3
Molecular weight
472.47
Exact mass
472.1722
XLogP
3.69
TPSA
76.46
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
34
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.292
Molar refractivity
117.57

Supplementary Information

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