이름: Diethyl 5-[3-(dimethylamino)acryloyl]-1,6-dihydro-6-oxo-2,3-pyridinedicarboxylate
SMILES:
CCOC(=O)c1cc(C(=O)C=CN(C)C)c(=O)[nH]c1C(=O)OCCMolecular Processing
Molecular formula
C16H20N2O6
Molecular weight
336.34
Exact mass
336.1321
XLogP
0.99
TPSA
105.77
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
24
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
86.13
Supplementary Information
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