Name: tert-butyl 4-((5R,7R)-7-hydroxy-5-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)piperidine-1-carboxylate
SMILES:
C[C@@H]1C[C@@H](O)c2ncnc(C3CCN(C(=O)OC(C)(C)C)CC3)c21Molecular Processing
Molecular formula
C18H27N3O3
Molecular weight
333.43
Exact mass
333.2052
XLogP
3.13
TPSA
75.55
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
24
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.722
Molar refractivity
89.81
Supplementary Information
Details werden geladen…
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