이름: 1,1-dimethylethyl 4-(2-methyl-5-quinolinyl)-1-piperazinecarboxylate
SMILES:
Cc1ccc2c(N3CCN(C(=O)OC(C)(C)C)CC3)cccc2n1Molecular Processing
Molecular formula
C19H25N3O2
Molecular weight
327.43
Exact mass
327.1947
XLogP
3.6
TPSA
45.67
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.474
Molar refractivity
96.5
Supplementary Information
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