Name: methyl 2-(((benzyloxy)carbonyl)amino)-3-(1,3-dimethyl-2,4-dioxo-5-phenyl-3,4-dihydro-1H-pyrrolo[3,4-d]pyrimidin-6(2H)-yl)propanoate
SMILES:
COC(=O)C(Cn1cc2c(c1-c1ccccc1)c(=O)n(C)c(=O)n2C)NC(=O)OCc1ccccc1Molecular Processing
Molecular formula
C26H26N4O6
Molecular weight
490.52
Exact mass
490.1852
XLogP
2.17
TPSA
113.56
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
36
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
133.42
Supplementary Information
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