이름: Ethyl 1,6-dihydro-2-(2,5-dimethylanilino)-6-oxo-5-pyrimidinecarboxylate
SMILES:
CCOC(=O)c1cnc(Nc2cc(C)ccc2C)[nH]c1=OMolecular Processing
Molecular formula
C15H17N3O3
Molecular weight
287.32
Exact mass
287.127
XLogP
2.31
TPSA
84.08
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
80.01
Supplementary Information
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