이름: amine
SMILES:
CN(C)C(=O)N1CC(c2cc(F)ccc2F)=CC1(CCCNCC(F)F)c1ccccc1Molecular Processing
Molecular formula
C24H27F4N3O
Molecular weight
449.49
Exact mass
449.209
XLogP
4.88
TPSA
35.58
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
8
Heavy atoms
32
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
116.35
Supplementary Information
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