이름: 4-ethylamino-2-phenylamino-pyrimidine-5-carboxylic acid ethyl ester
SMILES:
CCNc1nc(Nc2ccccc2)ncc1C(=O)OCCMolecular Processing
Molecular formula
C15H18N4O2
Molecular weight
286.34
Exact mass
286.143
XLogP
2.83
TPSA
76.14
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
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
81.88
Supplementary Information
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