Name: ethyl 4′-methyl-5-((2-methylpyrimidin-5-yl)methylcarbamoyl)-biphenyl-3-carboxylate
SMILES:
CCOC(=O)c1cc(C(=O)NCc2cnc(C)nc2)cc(-c2ccc(C)cc2)c1Molecular Processing
Molecular formula
C23H23N3O3
Molecular weight
389.46
Exact mass
389.1739
XLogP
3.87
TPSA
81.18
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.217
Molar refractivity
110.51
Supplementary Information
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