Nc1nc(O)cc(C2CCCN(C(=O)OCc3ccccc3)C2)n1
الاسم: benzyl 3-(2-amino-6-oxo-1H-pyrimidin-4-yl)piperidine-1-carboxylate
SMILES: Nc1nc(O)cc(C2CCCN(C(=O)OCc3ccccc3)C2)n1

Molecular Processing

Molecular formula
C17H20N4O3
Molecular weight
328.37
Exact mass
328.1535
XLogP
2.28
TPSA
101.57
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
24
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.353
Molar refractivity
88.28

Supplementary Information

InChIKey: UFZWTYYILZNDBD-UHFFFAOYSA-N
مرادفات
SCHEMBL2876671UFZWTYYILZNDBD-UHFFFAOYSA-NBenzyl 3-(2-amino-6-hydroxypyrimidin-4-yl)piperidine-1-carboxylate
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