이름: tert-butyl 2-(7-(3-cyanophenyl)-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxamido)acetate
SMILES:
Cn1c(=O)c(C(=O)NCC(=O)OC(C)(C)C)c(O)c2ccc(-c3cccc(C#N)c3)cc21Molecular Processing
Molecular formula
C24H23N3O5
Molecular weight
433.46
Exact mass
433.1638
XLogP
2.85
TPSA
121.42
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
32
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
119.18
Supplementary Information
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